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125617-30-3 | 2-Oxiranemethanol, 3-(3-chlorophenyl)-
CAS No: 125617-30-3 Catalog No: AG000NYV MDL No:
Product Description
Catalog Number:
AG000NYV
Chemical Name:
2-Oxiranemethanol, 3-(3-chlorophenyl)-
CAS Number:
125617-30-3
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
IUPAC Name:
[3-(3-chlorophenyl)oxiran-2-yl]methanol
InChI:
InChI=1S/C9H9ClO2/c10-7-3-1-2-6(4-7)9-8(5-11)12-9/h1-4,8-9,11H,5H2
InChI Key:
CBVIYQISIWXPFD-UHFFFAOYSA-N
SMILES:
OCC1OC1c1cccc(c1)Cl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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