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37687-57-3 | 2-Chloro-3-hydroxy-4-methoxybenzaldehyde
CAS No: 37687-57-3 Catalog No: AG003GVM MDL No:MFCD03425852
Product Description
Catalog Number:
AG003GVM
Chemical Name:
2-Chloro-3-hydroxy-4-methoxybenzaldehyde
CAS Number:
37687-57-3
Molecular Formula:
C8H7ClO3
Molecular Weight:
186.5924
MDL Number:
MFCD03425852
IUPAC Name:
2-chloro-3-hydroxy-4-methoxybenzaldehyde
InChI:
InChI=1S/C8H7ClO3/c1-12-6-3-2-5(4-10)7(9)8(6)11/h2-4,11H,1H3
InChI Key:
DTMJGFBJQBQOIA-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1O)Cl)C=O
EC Number:
253-627-9
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.008g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.591g/mol
Monoisotopic Mass:
186.008g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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