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20764-35-6 | Benzene, 1-(2-chloroethoxy)-4-methyl-
CAS No: 20764-35-6 Catalog No: AG002J6P MDL No:MFCD00634281
Product Description
Catalog Number:
AG002J6P
Chemical Name:
Benzene, 1-(2-chloroethoxy)-4-methyl-
CAS Number:
20764-35-6
Molecular Formula:
C9H11ClO
Molecular Weight:
170.6360
MDL Number:
MFCD00634281
IUPAC Name:
1-(2-chloroethoxy)-4-methylbenzene
InChI:
InChI=1S/C9H11ClO/c1-8-2-4-9(5-3-8)11-7-6-10/h2-5H,6-7H2,1H3
InChI Key:
KBYIVQGBGSZJRP-UHFFFAOYSA-N
SMILES:
ClCCOc1ccc(cc1)C
Properties
Complexity:
97.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.05g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.636g/mol
Monoisotopic Mass:
170.05g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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