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1587-07-1 | Benzene, 1-chloro-2-(2-propen-1-yl)-
CAS No: 1587-07-1 Catalog No: AG001QRU MDL No:MFCD00135025
Product Description
Catalog Number:
AG001QRU
Chemical Name:
Benzene, 1-chloro-2-(2-propen-1-yl)-
CAS Number:
1587-07-1
Molecular Formula:
C9H9Cl
Molecular Weight:
152.6208
MDL Number:
MFCD00135025
IUPAC Name:
1-chloro-2-prop-2-enylbenzene
InChI:
InChI=1S/C9H9Cl/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7H,1,5H2
InChI Key:
MMNZJCWUBKBTNG-UHFFFAOYSA-N
SMILES:
C=CCc1ccccc1Cl
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.039g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.621g/mol
Monoisotopic Mass:
152.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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