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1515-91-9 | Benzene, 1-chloro-3-(methoxymethyl)-
CAS No: 1515-91-9 Catalog No: AG001NDF MDL No:
Product Description
Catalog Number:
AG001NDF
Chemical Name:
Benzene, 1-chloro-3-(methoxymethyl)-
CAS Number:
1515-91-9
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
IUPAC Name:
1-chloro-3-(methoxymethyl)benzene
InChI:
InChI=1S/C8H9ClO/c1-10-6-7-3-2-4-8(9)5-7/h2-5H,6H2,1H3
InChI Key:
ICZYALZVHVFXDJ-UHFFFAOYSA-N
SMILES:
COCc1cccc(c1)Cl
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.034g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.609g/mol
Monoisotopic Mass:
156.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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