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64834-58-8 | 2-(2-CHLORO-BENZYLAMINO)-ETHANOL
CAS No: 64834-58-8 Catalog No: AG00EAT2 MDL No:MFCD05863670
Product Description
Catalog Number:
AG00EAT2
Chemical Name:
2-(2-CHLORO-BENZYLAMINO)-ETHANOL
CAS Number:
64834-58-8
Molecular Formula:
C9H12ClNO
Molecular Weight:
185.6507
MDL Number:
MFCD05863670
IUPAC Name:
2-[(2-chlorophenyl)methylamino]ethanol
InChI:
InChI=1S/C9H12ClNO/c10-9-4-2-1-3-8(9)7-11-5-6-12/h1-4,11-12H,5-7H2
InChI Key:
SBTVFWBGEIPFDO-UHFFFAOYSA-N
SMILES:
OCCNCc1ccccc1Cl
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.651g/mol
Monoisotopic Mass:
185.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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