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40794-04-5 | 4-Chloro-2-methoxy-1-methylbenzene
CAS No: 40794-04-5 Catalog No: AG00758B MDL No:MFCD07368289
Product Description
Catalog Number:
AG00758B
Chemical Name:
4-Chloro-2-methoxy-1-methylbenzene
CAS Number:
40794-04-5
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
MDL Number:
MFCD07368289
IUPAC Name:
4-chloro-2-methoxy-1-methylbenzene
InChI:
InChI=1S/C8H9ClO/c1-6-3-4-7(9)5-8(6)10-2/h3-5H,1-2H3
InChI Key:
RFZOGPABZLMDQW-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)ccc1C
EC Number:
609-865-4
NSC Number:
159042
Properties
Complexity:
105
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:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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