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Home > Nitro Compounds > 6936-51-2
6936-51-2 | ethyl nitroso(phenyl)carbamate
CAS No: 6936-51-2 Catalog No: AG005N90 MDL No:
Product Description
Catalog Number:
AG005N90
Chemical Name:
ethyl nitroso(phenyl)carbamate
CAS Number:
6936-51-2
Molecular Formula:
C9H10N2O3
Molecular Weight:
194.1873
IUPAC Name:
ethyl N-nitroso-N-phenylcarbamate
InChI:
InChI=1S/C9H10N2O3/c1-2-14-9(12)11(10-13)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChI Key:
SOCICUCJTHKVFE-UHFFFAOYSA-N
SMILES:
CCOC(=O)N(c1ccccc1)N=O
NSC Number:
22456
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.19g/mol
Monoisotopic Mass:
194.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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