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3519-76-4 | 2,4-dihydroxy-6-methoxybenzaldehyde
CAS No: 3519-76-4 Catalog No: AG01DIDZ MDL No:MFCD24673730
Product Description
Catalog Number:
AG01DIDZ
Chemical Name:
2,4-dihydroxy-6-methoxybenzaldehyde
CAS Number:
3519-76-4
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
MDL Number:
MFCD24673730
IUPAC Name:
2,4-dihydroxy-6-methoxybenzaldehyde
InChI:
InChI=1S/C8H8O4/c1-12-8-3-5(10)2-7(11)6(8)4-9/h2-4,10-11H,1H3
InChI Key:
ABNNGIOYMQTQQO-UHFFFAOYSA-N
SMILES:
COc1cc(O)cc(c1C=O)O
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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