Name: Name:5-Chloro-7-nitro-2,3-dihydro-1,3-benzoxazol-2-one
Brand: Angene
SKU: AG0055BT
Rating: 90 (10 reviews)

5-Chloro-7-nitro-2,3-dihydro-1,3-benzoxazol-2-one

CAS No.:

811810-67-0

Catalog Number:

AG0055BT

Molecular Formula:

C7H3ClN2O4

Molecular Weight:

214.5627

Catalog Number:

AG0055BT

Chemical Name:

5-Chloro-7-nitro-2,3-dihydro-1,3-benzoxazol-2-one

CAS Number:

811810-67-0

Molecular Formula:

C7H3ClN2O4

Molecular Weight:

214.5627

MDL Number:

MFCD09753602

IUPAC Name:

5-chloro-7-nitro-3H-1,3-benzoxazol-2-one

InChI:

InChI=1S/C7H3ClN2O4/c8-3-1-4-6(14-7(11)9-4)5(2-3)10(12)13/h1-2H,(H,9,11)

InChI Key:

CRZGVTHVMCEWRC-UHFFFAOYSA-N

SMILES:

Clc1cc2[nH]c(=O)oc2c(c1)[N+](=O)[O-]

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

213.978g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.561g/mol

Monoisotopic Mass:

213.978g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6