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Home > Aldehydes > 1379345-56-8
1379345-56-8 | Benzaldehyde, 2-amino-4,6-dimethoxy-
CAS No: 1379345-56-8 Catalog No: AG0017NI MDL No:
Product Description
Catalog Number:
AG0017NI
Chemical Name:
Benzaldehyde, 2-amino-4,6-dimethoxy-
CAS Number:
1379345-56-8
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
IUPAC Name:
2-amino-4,6-dimethoxybenzaldehyde
InChI:
InChI=1S/C9H11NO3/c1-12-6-3-8(10)7(5-11)9(4-6)13-2/h3-5H,10H2,1-2H3
InChI Key:
COAXIOJDOLFZBM-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1C=O)N
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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