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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O2
Molecular Weight 192.2542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-METHOXYPHENYL)PENTAN-1-ONE

SMILES

CCCCC(=O)C1=CC=C(OC)C=C1

InChI

InChIKey=HNHLNYCFOLMJHR-UHFFFAOYSA-N
InChI=1S/C12H16O2/c1-3-4-5-12(13)10-6-8-11(14-2)9-7-10/h6-9H,3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H16O2
Molecular Weight 192.2542
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:46:06 GMT 2025
Edited
by admin
on Tue Apr 01 17:46:06 GMT 2025
Record UNII
CRF9XE6C9T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-METHOXYPHENYL)PENTAN-1-ONE
Systematic Name English
NSC-406939
Preferred Name English
p-Methoxyvalerophenone
Common Name English
Valerophenone, 4?-methoxy-
Common Name English
4-Methoxyvalerophenone
Common Name English
1-(4-Methoxyphenyl)-1-pentanone
Systematic Name English
4?-Methoxyvalerophenone
Common Name English
Butyl 4-methoxyphenyl ketone
Common Name English
1-Pentanone, 1-(4-methoxyphenyl)-
Systematic Name English
Code System Code Type Description
FDA UNII
CRF9XE6C9T
Created by admin on Tue Apr 01 17:46:06 GMT 2025 , Edited by admin on Tue Apr 01 17:46:06 GMT 2025
PRIMARY
PUBCHEM
74283
Created by admin on Tue Apr 01 17:46:06 GMT 2025 , Edited by admin on Tue Apr 01 17:46:06 GMT 2025
PRIMARY
CAS
1671-76-7
Created by admin on Tue Apr 01 17:46:06 GMT 2025 , Edited by admin on Tue Apr 01 17:46:06 GMT 2025
PRIMARY
EPA CompTox
DTXSID70168227
Created by admin on Tue Apr 01 17:46:06 GMT 2025 , Edited by admin on Tue Apr 01 17:46:06 GMT 2025
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NSC
406939
Created by admin on Tue Apr 01 17:46:06 GMT 2025 , Edited by admin on Tue Apr 01 17:46:06 GMT 2025
PRIMARY
ECHA (EC/EINECS)
216-803-6
Created by admin on Tue Apr 01 17:46:06 GMT 2025 , Edited by admin on Tue Apr 01 17:46:06 GMT 2025
PRIMARY