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1314935-28-8 | 3-(4-Chloro-3-ethylphenyl)-1-propene
CAS No: 1314935-28-8 Catalog No: AG01FDHU MDL No:
Product Description
Catalog Number:
AG01FDHU
Chemical Name:
3-(4-Chloro-3-ethylphenyl)-1-propene
CAS Number:
1314935-28-8
Molecular Formula:
C11H13Cl
Molecular Weight:
180.6739
IUPAC Name:
1-chloro-2-ethyl-4-prop-2-enylbenzene
InChI:
InChI=1S/C11H13Cl/c1-3-5-9-6-7-11(12)10(4-2)8-9/h3,6-8H,1,4-5H2,2H3
InChI Key:
ZRGAADQQPDHSGT-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(c(c1)CC)Cl
Properties
Complexity:
142
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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