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18268-68-3 | Benzaldehyde, 3-chloro-4,5-dimethoxy-
CAS No: 18268-68-3 Catalog No: AG00241Z MDL No:MFCD02256335
Product Description
Catalog Number:
AG00241Z
Chemical Name:
Benzaldehyde, 3-chloro-4,5-dimethoxy-
CAS Number:
18268-68-3
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
MDL Number:
MFCD02256335
IUPAC Name:
3-chloro-4,5-dimethoxybenzaldehyde
InChI:
InChI=1S/C9H9ClO3/c1-12-8-4-6(5-11)3-7(10)9(8)13-2/h3-5H,1-2H3
InChI Key:
AMZCHEDPEAQEMC-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)cc(c1OC)Cl
NSC Number:
45931
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.618g/mol
Monoisotopic Mass:
200.024g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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