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128994-25-2 | Oxirane, 2-[(2-chlorophenoxy)methyl]-, (2S)-
CAS No: 128994-25-2 Catalog No: AG000YQR MDL No:MFCD08752554
Product Description
Catalog Number:
AG000YQR
Chemical Name:
Oxirane, 2-[(2-chlorophenoxy)methyl]-, (2S)-
CAS Number:
128994-25-2
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD08752554
IUPAC Name:
(2S)-2-[(2-chlorophenoxy)methyl]oxirane
InChI:
InChI=1S/C9H9ClO2/c10-8-3-1-2-4-9(8)12-6-7-5-11-7/h1-4,7H,5-6H2/t7-/m0/s1
InChI Key:
IYFFPRFMOMGBGB-ZETCQYMHSA-N
SMILES:
Clc1ccccc1OC[C@@H]1CO1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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