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Home > Nitro Compounds > 1156433-64-5
1156433-64-5 | N-(cyclopropylmethyl)-3-nitroaniline
CAS No: 1156433-64-5 Catalog No: AG01AYNR MDL No:MFCD12175147
Product Description
Catalog Number:
AG01AYNR
Chemical Name:
N-(cyclopropylmethyl)-3-nitroaniline
CAS Number:
1156433-64-5
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
MDL Number:
MFCD12175147
IUPAC Name:
N-(cyclopropylmethyl)-3-nitroaniline
InChI:
InChI=1S/C10H12N2O2/c13-12(14)10-3-1-2-9(6-10)11-7-8-4-5-8/h1-3,6,8,11H,4-5,7H2
InChI Key:
QWRXMOJOTLCPNE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)NCC1CC1
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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