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1504-71-8 | 2-Propen-1-ol, 3-(2-chlorophenyl)-
CAS No: 1504-71-8 Catalog No: AG001MLS MDL No:
Product Description
Catalog Number:
AG001MLS
Chemical Name:
2-Propen-1-ol, 3-(2-chlorophenyl)-
CAS Number:
1504-71-8
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
IUPAC Name:
3-(2-chlorophenyl)prop-2-en-1-ol
InChI:
InChI=1S/C9H9ClO/c10-9-6-2-1-4-8(9)5-3-7-11/h1-6,11H,7H2
InChI Key:
VSDGYZONTQWZIN-UHFFFAOYSA-N
SMILES:
OCC=Cc1ccccc1Cl
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.034g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.62g/mol
Monoisotopic Mass:
168.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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