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14568-97-9 | Benzene, 1-(2-chloro-2-propen-1-yl)-4-methyl-
CAS No: 14568-97-9 Catalog No: AG001DAM MDL No:
Product Description
Catalog Number:
AG001DAM
Chemical Name:
Benzene, 1-(2-chloro-2-propen-1-yl)-4-methyl-
CAS Number:
14568-97-9
Molecular Formula:
C10H11Cl
Molecular Weight:
166.6473
IUPAC Name:
1-(2-chloroprop-2-enyl)-4-methylbenzene
InChI:
InChI=1S/C10H11Cl/c1-8-3-5-10(6-4-8)7-9(2)11/h3-6H,2,7H2,1H3
InChI Key:
ZMXKUMKPRPSCQO-UHFFFAOYSA-N
SMILES:
ClC(=C)Cc1ccc(cc1)C
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.055g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.648g/mol
Monoisotopic Mass:
166.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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