Name: Name:Benzene, 2-chloro-1-methyl-3,5-dinitro-
Brand: Angene
SKU: AG002HS1
Rating: 90 (10 reviews)

Benzene, 2-chloro-1-methyl-3,5-dinitro-

CAS No.:

18905-50-5

Catalog Number:

AG002HS1

Molecular Formula:

C7H5ClN2O4

Molecular Weight:

216.5786

Catalog Number:

AG002HS1

Chemical Name:

Benzene, 2-chloro-1-methyl-3,5-dinitro-

CAS Number:

18905-50-5

Molecular Formula:

C7H5ClN2O4

Molecular Weight:

216.5786

MDL Number:

MFCD00460854

IUPAC Name:

2-chloro-1-methyl-3,5-dinitrobenzene

InChI:

InChI=1S/C7H5ClN2O4/c1-4-2-5(9(11)12)3-6(7(4)8)10(13)14/h2-3H,1H3

InChI Key:

FXMUNKFQIKDUBF-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(C)c(c(c1)[N+](=O)[O-])Cl

NSC Number:

159598

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

215.994g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

216.577g/mol

Monoisotopic Mass:

215.994g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6