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

Details

Stereochemistry RACEMIC
Molecular Formula C8H14O2
Molecular Weight 142.1956
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 2-METHYL-3-PENTENOATE, (3E)-

SMILES

CCOC(=O)C(C)\C=C\C

InChI

InChIKey=HOWBPXBYCPKWBL-GQCTYLIASA-N
InChI=1S/C8H14O2/c1-4-6-7(3)8(9)10-5-2/h4,6-7H,5H2,1-3H3/b6-4+

HIDE SMILES / InChI

Molecular Formula C8H14O2
Molecular Weight 142.1956
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:03:05 GMT 2023
Edited
by admin
on Sat Dec 16 00:03:05 GMT 2023
Record UNII
37FR080RET
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 2-METHYL-3-PENTENOATE, (3E)-
Systematic Name English
ETHYL (E)-2-METHYLPENT-3-ENOATE
Systematic Name English
(±)-3-PENTENOIC ACID, 2-METHYL-, ETHYL ESTER, (3E)-
Common Name English
3-PENTENOIC ACID, 2-METHYL-, ETHYL ESTER, (3E)-
Common Name English
FEMA NO. 3456, E-
Code English
3-PENTENOIC ACID, 2-METHYL-, ETHYL ESTER, (E)-
Common Name English
Code System Code Type Description
PUBCHEM
5463855
Created by admin on Sat Dec 16 00:03:05 GMT 2023 , Edited by admin on Sat Dec 16 00:03:05 GMT 2023
PRIMARY
CAS
16489-03-5
Created by admin on Sat Dec 16 00:03:05 GMT 2023 , Edited by admin on Sat Dec 16 00:03:05 GMT 2023
PRIMARY
FDA UNII
37FR080RET
Created by admin on Sat Dec 16 00:03:05 GMT 2023 , Edited by admin on Sat Dec 16 00:03:05 GMT 2023
PRIMARY