Home Halogens Benzene, 1-(chloromethyl)-3-(1-methylethyl)-

Benzene, 1-(chloromethyl)-3-(1-methylethyl)-

CAS No.:
74705-35-4
Catalog Number:
AG005UNX
Molecular Formula:
C10H13Cl
Molecular Weight:
168.6632
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Product Description
Catalog Number:
AG005UNX
Chemical Name:
Benzene, 1-(chloromethyl)-3-(1-methylethyl)-
CAS Number:
74705-35-4
Molecular Formula:
C10H13Cl
Molecular Weight:
168.6632
MDL Number:
MFCD19232503
IUPAC Name:
1-(chloromethyl)-3-propan-2-ylbenzene
InChI:
InChI=1S/C10H13Cl/c1-8(2)10-5-3-4-9(6-10)7-11/h3-6,8H,7H2,1-2H3
InChI Key:
OCFXNUNCMJFLML-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)C(C)C
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.071g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.664g/mol
Monoisotopic Mass:
168.071g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties