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Details

Stereochemistry UNKNOWN
Molecular Formula C8H18O
Molecular Weight 130.2279
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYL-3-HEPTANOL

SMILES

CCCC(C)C(O)CC

InChI

InChIKey=BKQICAFAUMRYLZ-UHFFFAOYSA-N
InChI=1S/C8H18O/c1-4-6-7(3)8(9)5-2/h7-9H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C8H18O
Molecular Weight 130.2279
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:32:31 GMT 2023
Edited
by admin
on Sat Dec 16 09:32:31 GMT 2023
Record UNII
L4RU749510
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-METHYL-3-HEPTANOL
Systematic Name English
4-METHYL-3-HEPTANOL, ERYTHRO + THREO
Common Name English
NSC-93808
Code English
4-METHYL-3-HEPTANOL, MIXTURE OF ISOMERS
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 118101
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
Code System Code Type Description
NSC
93808
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID0041519
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
239-058-9
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
PRIMARY
FDA UNII
L4RU749510
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
PRIMARY
PUBCHEM
26989
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
PRIMARY
CAS
14979-39-6
Created by admin on Sat Dec 16 09:32:31 GMT 2023 , Edited by admin on Sat Dec 16 09:32:31 GMT 2023
PRIMARY