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Home > Nitro Compounds > 14442-54-7
14442-54-7 | Carbamic acid, N-methyl-N-nitro-, methyl ester
CAS No: 14442-54-7 Catalog No: AG001JHW MDL No:
Product Description
Catalog Number:
AG001JHW
Chemical Name:
Carbamic acid, N-methyl-N-nitro-, methyl ester
CAS Number:
14442-54-7
Molecular Formula:
C3H6N2O4
Molecular Weight:
134.0907
IUPAC Name:
methyl N-methyl-N-nitrocarbamate
InChI:
InChI=1S/C3H6N2O4/c1-4(5(7)8)3(6)9-2/h1-2H3
InChI Key:
SCASXMBTFPUSSI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)N(C(=O)OC)C
NSC Number:
28521
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.033g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.091g/mol
Monoisotopic Mass:
134.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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