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Home > Aldehydes > 396068-88-5
396068-88-5 | Benzaldehyde, 3-(dimethylamino)-4-hydroxy-5-methoxy-
CAS No: 396068-88-5 Catalog No: AG00787B MDL No:
Product Description
Catalog Number:
AG00787B
Chemical Name:
Benzaldehyde, 3-(dimethylamino)-4-hydroxy-5-methoxy-
CAS Number:
396068-88-5
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
IUPAC Name:
3-(dimethylamino)-4-hydroxy-5-methoxybenzaldehyde
InChI:
InChI=1S/C10H13NO3/c1-11(2)8-4-7(6-12)5-9(14-3)10(8)13/h4-6,13H,1-3H3
InChI Key:
HULSMIBKPKOBML-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)c(c(c1)N(C)C)O
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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