Home Nitros (1S)-1-(3-nitrophenyl)propan-1-amine hydrochloride

(1S)-1-(3-nitrophenyl)propan-1-amine hydrochloride

CAS No.:
873893-97-1
Catalog Number:
AG01A36N
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
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Product Description
Catalog Number:
AG01A36N
Chemical Name:
(1S)-1-(3-nitrophenyl)propan-1-amine hydrochloride
CAS Number:
873893-97-1
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
MDL Number:
MFCD22628529
IUPAC Name:
(1S)-1-(3-nitrophenyl)propan-1-amine;hydrochloride
InChI:
InChI=1S/C9H12N2O2.ClH/c1-2-9(10)7-4-3-5-8(6-7)11(12)13;/h3-6,9H,2,10H2,1H3;1H/t9-;/m0./s1
InChI Key:
DOUHSTOUMBJFNC-FVGYRXGTSA-N
SMILES:
CC[C@@H](c1cccc(c1)[N+](=O)[O-])N.Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
216.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.665g/mol
Monoisotopic Mass:
216.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties