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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H12O2
Molecular Weight 116.1583
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SEC-BUTYL ACETATE, (-)-

SMILES

CC[C@@H](C)OC(C)=O

InChI

InChIKey=DCKVNWZUADLDEH-RXMQYKEDSA-N
InChI=1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3/t5-/m1/s1

HIDE SMILES / InChI

Molecular Formula C6H12O2
Molecular Weight 116.1583
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:11:07 GMT 2023
Edited
by admin
on Sat Dec 16 09:11:07 GMT 2023
Record UNII
KU2W9MR8SY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SEC-BUTYL ACETATE, (-)-
Systematic Name English
(-)-2-BUTYL ACETATE
Systematic Name English
SEC-BUTYL ACETATE L-FORM [MI]
Common Name English
(2R)-2-ACETOXYBUTANE
Systematic Name English
(-)-SEC-BUTYL ACETATE
Systematic Name English
ACETIC ACID, (1R)-1-METHYLPROPYL ESTER
Systematic Name English
Code System Code Type Description
CAS
54657-08-8
Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023
PRIMARY
FDA UNII
KU2W9MR8SY
Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023
PRIMARY
MERCK INDEX
m2808
Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023
PRIMARY Merck Index
PUBCHEM
6950754
Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023
PRIMARY