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Details

Stereochemistry RACEMIC
Molecular Formula C14H20O
Molecular Weight 204.308
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-BENZYL-4-HEPTANONE

SMILES

CCCC(=O)C(CC)CC1=CC=CC=C1

InChI

InChIKey=CGTCWTIGDNJZOX-UHFFFAOYSA-N
InChI=1S/C14H20O/c1-3-8-14(15)13(4-2)11-12-9-6-5-7-10-12/h5-7,9-10,13H,3-4,8,11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H20O
Molecular Weight 204.308
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:09:47 GMT 2023
Edited
by admin
on Fri Dec 15 19:09:47 GMT 2023
Record UNII
64UYT55005
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-BENZYL-4-HEPTANONE
FHFI   USP-RS  
Systematic Name English
3-BENZYL-4-HEPTANONE [FHFI]
Common Name English
FEMA NO. 2146
Code English
4-HEPTANONE, 3-(PHENYLMETHYL)-
Systematic Name English
1-PHENYL-2-ETHYL-3-HEXANONE
Systematic Name English
1-BENZYLDIPROPYL KETONE
Common Name English
4-HEPTANONE, 3-BENZYL-
Systematic Name English
MORELLONE
Common Name English
3-BENZYL-4-HEPTANONE [USP-RS]
Common Name English
BENZYL DIPROPYL KETONE
Common Name English
Classification Tree Code System Code
JECFA EVALUATION 3-BENZYL-4-HEPTANONE
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
231-317-4
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY
RS_ITEM_NUM
1064058
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY
JECFA MONOGRAPH
750
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID50864073
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY
FDA UNII
64UYT55005
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY
CAS
7492-37-7
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY
PUBCHEM
5463905
Created by admin on Fri Dec 15 19:09:47 GMT 2023 , Edited by admin on Fri Dec 15 19:09:47 GMT 2023
PRIMARY