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116005-40-4 | Benzene, (1-chlorocyclopropyl)-
CAS No: 116005-40-4 Catalog No: AG000BD1 MDL No:MFCD17010979
Product Description
Catalog Number:
AG000BD1
Chemical Name:
Benzene, (1-chlorocyclopropyl)-
CAS Number:
116005-40-4
Molecular Formula:
C9H9Cl
Molecular Weight:
152.6208
MDL Number:
MFCD17010979
IUPAC Name:
(1-chlorocyclopropyl)benzene
InChI:
InChI=1S/C9H9Cl/c10-9(6-7-9)8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key:
SUVKLPMDBMSOOM-UHFFFAOYSA-N
SMILES:
ClC1(CC1)c1ccccc1
Properties
Complexity:
121
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:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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