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24835-08-3 | Benzenemethanamine, 2-nitro-, hydrochloride (1:1)
CAS No: 24835-08-3 Catalog No: AG002PM1 MDL No:MFCD00136280
Product Description
Catalog Number:
AG002PM1
Chemical Name:
Benzenemethanamine, 2-nitro-, hydrochloride (1:1)
CAS Number:
24835-08-3
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
MDL Number:
MFCD00136280
IUPAC Name:
(2-nitrophenyl)methanamine;hydrochloride
InChI:
InChI=1S/C7H8N2O2.ClH/c8-5-6-3-1-2-4-7(6)9(10)11;/h1-4H,5,8H2;1H
InChI Key:
BASJTVIZZDEQBJ-UHFFFAOYSA-N
SMILES:
NCc1ccccc1[N+](=O)[O-].Cl
NSC Number:
158602
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.611g/mol
Monoisotopic Mass:
188.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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