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Details

Stereochemistry ACHIRAL
Molecular Formula C13H10NO3PS
Molecular Weight 291.262
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Diphenyl phosphoroisothiocyanatidate

SMILES

O=P(OC1=CC=CC=C1)(OC2=CC=CC=C2)N=C=S

InChI

InChIKey=QYGWFFSAYBRMHH-UHFFFAOYSA-N
InChI=1S/C13H10NO3PS/c15-18(14-11-19,16-12-7-3-1-4-8-12)17-13-9-5-2-6-10-13/h1-10H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Diphenyl phosphoroisothiocyanatidate
Systematic Name English
NSC-4756
Preferred Name English
Diphenyl (isothiocyanato)phosphate
Systematic Name English
Phosphoroisothiocyanatidic acid, diphenyl ester
Systematic Name English
Phosphor(isothiocyanatidic) acid, diphenyl ester
Systematic Name English
Code System Code Type Description
PUBCHEM
79397
Created by admin on Tue Apr 01 18:51:12 GMT 2025 , Edited by admin on Tue Apr 01 18:51:12 GMT 2025
PRIMARY
ECHA (EC/EINECS)
226-447-3
Created by admin on Tue Apr 01 18:51:12 GMT 2025 , Edited by admin on Tue Apr 01 18:51:12 GMT 2025
PRIMARY
FDA UNII
JLR79EMU7C
Created by admin on Tue Apr 01 18:51:12 GMT 2025 , Edited by admin on Tue Apr 01 18:51:12 GMT 2025
PRIMARY
NSC
4756
Created by admin on Tue Apr 01 18:51:12 GMT 2025 , Edited by admin on Tue Apr 01 18:51:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID8063838
Created by admin on Tue Apr 01 18:51:12 GMT 2025 , Edited by admin on Tue Apr 01 18:51:12 GMT 2025
PRIMARY
CAS
5401-14-9
Created by admin on Tue Apr 01 18:51:12 GMT 2025 , Edited by admin on Tue Apr 01 18:51:12 GMT 2025
PRIMARY
NIH
NCATS
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