Home Nitros 2-(2-nitrophenyl)propan-1-amine

2-(2-nitrophenyl)propan-1-amine

CAS No.:
1256344-25-8
Catalog Number:
AG01C7NS
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
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Product Description
Catalog Number:
AG01C7NS
Chemical Name:
2-(2-nitrophenyl)propan-1-amine
CAS Number:
1256344-25-8
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
MDL Number:
MFCD26621116
IUPAC Name:
2-(2-nitrophenyl)propan-1-amine
InChI:
InChI=1S/C9H12N2O2/c1-7(6-10)8-4-2-3-5-9(8)11(12)13/h2-5,7H,6,10H2,1H3
InChI Key:
BTPIVOZKGRJHFY-UHFFFAOYSA-N
SMILES:
NCC(c1ccccc1[N+](=O)[O-])C
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.207g/mol
Monoisotopic Mass:
180.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties