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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H18O3
Molecular Weight 318.3658
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzyl p-(benzyloxy)benzoate

SMILES

O=C(OCC1=CC=CC=C1)C2=CC=C(OCC3=CC=CC=C3)C=C2

InChI

InChIKey=BPLKDVGMXNZCQO-UHFFFAOYSA-N
InChI=1S/C21H18O3/c22-21(24-16-18-9-5-2-6-10-18)19-11-13-20(14-12-19)23-15-17-7-3-1-4-8-17/h1-14H,15-16H2

HIDE SMILES / InChI

Approval Year

Name Type Language
Benzyl p-(benzyloxy)benzoate
Systematic Name English
NSC-141837
Code English
Benzyl 4-benzyloxybenzoate
Systematic Name English
Benzoic acid, 4-(phenylmethoxy)-, phenylmethyl ester
Systematic Name English
Phenylmethyl 4-(phenylmethoxy)benzoate
Systematic Name English
Code System Code Type Description
CAS
56442-22-9
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
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EPA CompTox
DTXSID30204998
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
260-185-0
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
PUBCHEM
91863
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
NSC
141837
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
FDA UNII
4YU76GHP4Z
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
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