U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C12H26O
Molecular Weight 186.3342
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYLOCTANOL

SMILES

CCCCCCC(CO)CCCC

InChI

InChIKey=XMVBHZBLHNOQON-UHFFFAOYSA-N
InChI=1S/C12H26O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h12-13H,3-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H26O
Molecular Weight 186.3342
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
The scent of urine spots of male mice, Mus musculus: Changes in chemical composition over time.
2006
Anaerobic degradation of nonylphenol in subtropical mangrove sediments.
2009 Jun 15
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:32:24 GMT 2023
Edited
by admin
on Sat Dec 16 00:32:24 GMT 2023
Record UNII
N442D9VO79
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTYLOCTANOL
INCI  
INCI  
Official Name English
ISOFOL 12 ALCOHOL
Brand Name English
1-OCTANOL, 2-BUTYL-
Systematic Name English
(±)-2-BUTYLOCTANOL
Systematic Name English
NSC-2414
Code English
2-BUTYL-1-OCTANOL
Systematic Name English
5-(HYDROXYMETHYL)UNDECANE
Systematic Name English
GUERBET DODECANOL
Common Name English
2-BUTYLOCTYL ALCOHOL
Systematic Name English
MICHEL XO-150-12 ISO-LAURYL ALCOHOL
Brand Name English
2-BUTYLOCTANOL
Systematic Name English
BUTYLOCTANOL [INCI]
Common Name English
2-BUTYLOCTANOL, (±)-
Systematic Name English
JARCOL I-12
Brand Name English
2-BUTYLOCTAN-1-OL
Systematic Name English
Code System Code Type Description
DAILYMED
N442D9VO79
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY
CAS
3913-02-8
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY
RXCUI
2602284
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
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EPA CompTox
DTXSID0044818
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY
CHEBI
84235
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
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FDA UNII
N442D9VO79
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY
ECHA (EC/EINECS)
223-470-0
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY
NSC
2414
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY
PUBCHEM
19800
Created by admin on Sat Dec 16 00:32:24 GMT 2023 , Edited by admin on Sat Dec 16 00:32:24 GMT 2023
PRIMARY