Home Halogens Benzeneethanol, β-aMino-3-chloro-, hydrochloride (1

Benzeneethanol, β-aMino-3-chloro-, hydrochloride (1

CAS No.:
1245623-78-2
Catalog Number:
AG009C9I
Molecular Formula:
C8H11Cl2NO
Molecular Weight:
208.0850
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Product Description
Catalog Number:
AG009C9I
Chemical Name:
Benzeneethanol, β-aMino-3-chloro-, hydrochloride (1
CAS Number:
1245623-78-2
Molecular Formula:
C8H11Cl2NO
Molecular Weight:
208.0850
MDL Number:
MFCD12758102
IUPAC Name:
(2R)-2-amino-2-(3-chlorophenyl)ethanol;hydrochloride
InChI:
InChI=1S/C8H10ClNO.ClH/c9-7-3-1-2-6(4-7)8(10)5-11;/h1-4,8,11H,5,10H2;1H/t8-;/m0./s1
InChI Key:
QAYBZIBCNZGNDV-QRPNPIFTSA-N
SMILES:
OC[C@@H](c1cccc(c1)Cl)N.Cl
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
207.022g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
208.082g/mol
Monoisotopic Mass:
207.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties