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1270584-62-7 | Benzenemethanamine, α-(1-methylethyl)-4-nitro-
CAS No: 1270584-62-7 Catalog No: AG000WMG MDL No:MFCD18701977
Product Description
Catalog Number:
AG000WMG
Chemical Name:
Benzenemethanamine, α-(1-methylethyl)-4-nitro-
CAS Number:
1270584-62-7
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD18701977
IUPAC Name:
2-methyl-1-(4-nitrophenyl)propan-1-amine
InChI:
InChI=1S/C10H14N2O2/c1-7(2)10(11)8-3-5-9(6-4-8)12(13)14/h3-7,10H,11H2,1-2H3
InChI Key:
KANNPIUFBNOZAC-UHFFFAOYSA-N
SMILES:
NC(c1ccc(cc1)[N+](=O)[O-])C(C)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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