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182155-36-8 | 2-Azetidinone, 3-hydroxy-3-methyl-4-phenyl-, (3R,4S)-
CAS No: 182155-36-8 Catalog No: AG0023EY MDL No:MFCD27946433
Product Description
Catalog Number:
AG0023EY
Chemical Name:
2-Azetidinone, 3-hydroxy-3-methyl-4-phenyl-, (3R,4S)-
CAS Number:
182155-36-8
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD27946433
IUPAC Name:
(3R,4S)-3-hydroxy-3-methyl-4-phenylazetidin-2-one
InChI:
InChI=1S/C10H11NO2/c1-10(13)8(11-9(10)12)7-5-3-2-4-6-7/h2-6,8,13H,1H3,(H,11,12)/t8-,10+/m0/s1
InChI Key:
CDGUTZOUCGKJAP-WCBMZHEXSA-N
SMILES:
O=C1N[C@H]([C@@]1(C)O)c1ccccc1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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