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18237-83-7 | Benzamide, N,N-bis(2-chloroethyl)-4-nitro-
CAS No: 18237-83-7 Catalog No: AG0023QD MDL No:
Product Description
Catalog Number:
AG0023QD
Chemical Name:
Benzamide, N,N-bis(2-chloroethyl)-4-nitro-
CAS Number:
18237-83-7
Molecular Formula:
C11H12Cl2N2O3
Molecular Weight:
291.1306
IUPAC Name:
N,N-bis(2-chloroethyl)-4-nitrobenzamide
InChI:
InChI=1S/C11H12Cl2N2O3/c12-5-7-14(8-6-13)11(16)9-1-3-10(4-2-9)15(17)18/h1-4H,5-8H2
InChI Key:
NMNJIQKNVNODPA-UHFFFAOYSA-N
SMILES:
ClCCN(C(=O)c1ccc(cc1)[N+](=O)[O-])CCCl
NSC Number:
240404
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.022g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.128g/mol
Monoisotopic Mass:
290.022g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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