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18093-05-5 | Benzaldehyde, 2-chloro-4,5-dimethoxy-
CAS No: 18093-05-5 Catalog No: AG0022HT MDL No:MFCD00461433
Product Description
Catalog Number:
AG0022HT
Chemical Name:
Benzaldehyde, 2-chloro-4,5-dimethoxy-
CAS Number:
18093-05-5
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
MDL Number:
MFCD00461433
IUPAC Name:
2-chloro-4,5-dimethoxybenzaldehyde
InChI:
InChI=1S/C9H9ClO3/c1-12-8-3-6(5-11)7(10)4-9(8)13-2/h3-5H,1-2H3
InChI Key:
KTLBJNXLHDMIRZ-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(cc1OC)Cl
NSC Number:
129825
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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