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14467-32-4 | Benzenemethanol, α-[[(1,1-dimethylethyl)amino]methyl]-, (αS)-
CAS No: 14467-32-4 Catalog No: AG001JYF MDL No:
Product Description
Catalog Number:
AG001JYF
Chemical Name:
Benzenemethanol, α-[[(1,1-dimethylethyl)amino]methyl]-, (αS)-
CAS Number:
14467-32-4
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
IUPAC Name:
(1S)-2-(tert-butylamino)-1-phenylethanol
InChI:
InChI=1S/C12H19NO/c1-12(2,3)13-9-11(14)10-7-5-4-6-8-10/h4-8,11,13-14H,9H2,1-3H3/t11-/m1/s1
InChI Key:
NRVOOKOHYKJCPB-LLVKDONJSA-N
SMILES:
O[C@@H](c1ccccc1)CNC(C)(C)C
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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