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143701-19-3 | Benzene, (4-chloro-1-methyl-2-buten-1-yl)-
CAS No: 143701-19-3 Catalog No: AG001I81 MDL No:
Product Description
Catalog Number:
AG001I81
Chemical Name:
Benzene, (4-chloro-1-methyl-2-buten-1-yl)-
CAS Number:
143701-19-3
Molecular Formula:
C11H13Cl
Molecular Weight:
180.6739
IUPAC Name:
5-chloropent-3-en-2-ylbenzene
InChI:
InChI=1S/C11H13Cl/c1-10(6-5-9-12)11-7-3-2-4-8-11/h2-8,10H,9H2,1H3
InChI Key:
HFZXKDHVFPQJIO-UHFFFAOYSA-N
SMILES:
ClCC=CC(c1ccccc1)C
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.071g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.675g/mol
Monoisotopic Mass:
180.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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