Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.7.1
Substance Class Chemical
Record UNII
1BR7X184L5
Record Status Validated
Record Version
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Details

Stereochemistry ACHIRAL
Molecular Formula C5H10O2
Molecular Weight 102.1317
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0
Created by admin on Sat Jun 26 12:22:25 EDT 2021
Edited by GUEST on Wed Jul 21 15:40:47 EDT 2021
Structure of ISOVALERIC ACID

Systematic Names:

  • None recorded

SMILES

CC(C)CC(O)=O

InChI

GWYFCOCPABKNJV-UHFFFAOYSA-N
InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)
Name Type Language Details Access References
ISOVALERIC ACID
FCC   FHFI   HSDB   MART.   MI  
Systematic Name
English  
NSC-62783
Code
English  
ISOVALERIC ACID [WHO-DD]
Common Name
English  
ISOVALERIC ACID [MI]
Common Name
English  
ISOVALERIC ACID [MART.]
Common Name
English  
ISOVALERIC ACID [HSDB]
Common Name
English  
ISOVALERIC ACID [FHFI]
Common Name
English  
ISOVALERIC ACID [FCC]
Common Name
English  
ISOVALERIANIC ACID
Common Name
English  
ISOPROPYLACETIC ACID
Systematic Name
English  
ISOPENTANOIC ACID
Systematic Name
English  
FEMA NO. 3102
Code
English  
DELPHINIC-ACID
Common Name
English  
DELPHINIC ACID
Common Name
English  
BUTANOIC ACID, 3-METHYL-
Systematic Name
English  
ACETIC ACID, ISOPROPYL-
Common Name
English  
3-METHYLBUTANOIC ACID
Systematic Name
English  
.BETA.-METHYLBUTYRIC ACID
Systematic Name
English  
Classification Tree Code System Code Access References
CFR 21 CFR 172.515
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
JECFA EVALUATION ISOVALERIC ACID
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
Code System Code Type Description Access References
CAS
503-74-2
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
EVMPD
SUB130125
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
DRUG BANK
DB03750
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
ECHA (EC/EINECS)
207-975-3
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
EPA CompTox
503-74-2
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
FDA UNII
1BR7X184L5
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
HSDB
629
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
MERCK INDEX
M6547
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY Merck Index
MESH
C008216
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
PUBCHEM
10430
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
WIKIPEDIA
3-METHYLBUTANOIC ACID
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PRIMARY
Related Record Type Details Access References
SALT/SOLVATE -> PARENT
none
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
SALT/SOLVATE -> PARENT
none
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
SALT/SOLVATE -> PARENT
none
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
PARENT -> CONSTITUENT ALWAYS PRESENT
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
Related Record Type Details Access References
ACTIVE MOIETY
none
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 12:22:25 EDT 2021 , Edited by admin on Sat Jun 26 12:22:25 EDT 2021
Note Access References
[Validation]WARNING:Code '21 CFR 172.515'[CFR] collides (possible duplicate) with existing code & codeSystem for substance:
[307DN1208L]BENZYL PROPIONATE
Created Sat Jun 26 12:22:25 EDT 2021
Created By admin
Last Edited Sat Jun 26 12:22:25 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 ISOVALERIC ACID [MI] SRS_LOCATOR
2 HSDB SRS NOMEN
3 SCIFINDER SRS NOMEN
4 SRS CODE IMPORT SRS NOMEN Fri Apr 28 14:47:01 EDT 2017
5 MERCK SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED
6 WEBSITE WEBSITE NOMEN PUBLIC_DOMAIN_RELEASE
7 WEBSITE WEBSITE NOMEN PUBLIC_DOMAIN_RELEASE
8 ISOVALERIC ACID [FHFI] SRS_LOCATOR
9 SRS import [1BR7X184L5] SRS NOMEN Fri Apr 28 14:47:01 EDT 2017
10 STN STN (SCIFINDER)
11 FHFI SRS NOMEN
12 AN OVERVIEW OF THE EFFECTS OF TOBACCO INGREDIENTS ON SMOKE CHEMISTRY AND TOXICITY; FOOD AND CHEMICAL TOXICOLOGY; BAKER, RR; 42(SUPPL):53-83, 2004 JOURNAL ARTICLE NOMEN
13 FCC SRS NOMEN
14 Merck SRS NOMEN
15 ISOVALERIC ACID [HSDB] SRS_LOCATOR
16 CHEMID 2010 SRS NOMEN
17 MERCK INDEX SRS NOMEN
18 ISOVALERIC ACID [MART.] SRS_LOCATOR
19 who WHO DRUG DICTIONARY NOMEN PUBLIC_DOMAIN_RELEASE
20 dump-public-2021-06-23_UPDATED.gsrs BATCH_IMPORT Sat Jun 26 12:21:58 EDT 2021
21 HERBAL MEDICINES 4TH ED 2013 BOOK NOMEN
22 GSRS System-generated Validation messages VALIDATION_MESSAGE Sat Jun 26 12:22:24 EDT 2021
23 ISOVALERIC ACID [FCC] SRS_LOCATOR
24 MERCK INDEX MERCK INDEX NOMEN
25 SYSTEM
26 MART SRS NOMEN

Molecular Formula C5H10O2
Molecular Weight 102.1317
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE