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102089-74-7 | Carbamic acid, N-[(1R)-2-hydroxy-1-phenylethyl]-, 1,1-dimethylethyl ester
CAS No: 102089-74-7 Catalog No: AG0006LR MDL No:MFCD00274205
Product Description
Catalog Number:
AG0006LR
Chemical Name:
Carbamic acid, N-[(1R)-2-hydroxy-1-phenylethyl]-, 1,1-dimethylethyl ester
CAS Number:
102089-74-7
Molecular Formula:
C13H19NO3
Molecular Weight:
237.2949
MDL Number:
MFCD00274205
IUPAC Name:
tert-butyl N-[(1R)-2-hydroxy-1-phenylethyl]carbamate
InChI:
InChI=1S/C13H19NO3/c1-13(2,3)17-12(16)14-11(9-15)10-7-5-4-6-8-10/h4-8,11,15H,9H2,1-3H3,(H,14,16)/t11-/m0/s1
InChI Key:
IBDIOGYTZBKRGI-NSHDSACASA-N
SMILES:
OC[C@@H](c1ccccc1)NC(=O)OC(C)(C)C
EC Number:
600-273-1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
237.136g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
237.299g/mol
Monoisotopic Mass:
237.136g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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