Home Halogens Benzeneethanol, b-amino-3,4-dichloro-

Benzeneethanol, b-amino-3,4-dichloro-

CAS No.:
188586-38-1
Catalog Number:
AG00AQDQ
Molecular Formula:
C8H9Cl2NO
Molecular Weight:
206.0692
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Product Description
Catalog Number:
AG00AQDQ
Chemical Name:
Benzeneethanol, b-amino-3,4-dichloro-
CAS Number:
188586-38-1
Molecular Formula:
C8H9Cl2NO
Molecular Weight:
206.0692
MDL Number:
MFCD12827189
IUPAC Name:
2-amino-2-(3,4-dichlorophenyl)ethanol
InChI:
InChI=1S/C8H9Cl2NO/c9-6-2-1-5(3-7(6)10)8(11)4-12/h1-3,8,12H,4,11H2
InChI Key:
LXYGOSJYDNZVTO-UHFFFAOYSA-N
SMILES:
OCC(c1ccc(c(c1)Cl)Cl)N
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.006g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.066g/mol
Monoisotopic Mass:
205.006g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties