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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18N3O10P
Molecular Weight 503.3555
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Tris(5-methyl-2-nitrophenyl) phosphate

SMILES

CC1=CC(OP(=O)(OC2=CC(C)=CC=C2[N+]([O-])=O)OC3=C(C=CC(C)=C3)[N+]([O-])=O)=C(C=C1)[N+]([O-])=O

InChI

InChIKey=STACPXMRQXVFEV-UHFFFAOYSA-N
InChI=1S/C21H18N3O10P/c1-13-4-7-16(22(25)26)19(10-13)32-35(31,33-20-11-14(2)5-8-17(20)23(27)28)34-21-12-15(3)6-9-18(21)24(29)30/h4-12H,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Tris(5-methyl-2-nitrophenyl) phosphate
Systematic Name English
Phenol, 5-methyl-2-nitro-, 1,1′,1′′-phosphate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID5021702
Created by admin on Sat Dec 16 08:57:33 GMT 2023 , Edited by admin on Sat Dec 16 08:57:33 GMT 2023
PRIMARY
CAS
201742-26-9
Created by admin on Sat Dec 16 08:57:33 GMT 2023 , Edited by admin on Sat Dec 16 08:57:33 GMT 2023
PRIMARY
PUBCHEM
5171384
Created by admin on Sat Dec 16 08:57:33 GMT 2023 , Edited by admin on Sat Dec 16 08:57:33 GMT 2023
PRIMARY
FDA UNII
65GZA4966P
Created by admin on Sat Dec 16 08:57:33 GMT 2023 , Edited by admin on Sat Dec 16 08:57:33 GMT 2023
PRIMARY
NIH
NCATS
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