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16254-21-0 | Benzenemethanol, 4-chloro-α-[2-(dimethylamino)ethyl]-
CAS No: 16254-21-0 Catalog No: AG001T93 MDL No:
Product Description
Catalog Number:
AG001T93
Chemical Name:
Benzenemethanol, 4-chloro-α-[2-(dimethylamino)ethyl]-
CAS Number:
16254-21-0
Molecular Formula:
C11H16ClNO
Molecular Weight:
213.7038
IUPAC Name:
1-(4-chlorophenyl)-3-(dimethylamino)propan-1-ol
InChI:
InChI=1S/C11H16ClNO/c1-13(2)8-7-11(14)9-3-5-10(12)6-4-9/h3-6,11,14H,7-8H2,1-2H3
InChI Key:
GXYMVYGPHADUNW-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)Cl)CCN(C)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.705g/mol
Monoisotopic Mass:
213.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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