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503837-71-6 | BENZALDEHYDE, 4-METHYL-2-(METHYLAMINO)-
CAS No: 503837-71-6 Catalog No: AG006U6Y MDL No:
Product Description
Catalog Number:
AG006U6Y
Chemical Name:
BENZALDEHYDE, 4-METHYL-2-(METHYLAMINO)-
CAS Number:
503837-71-6
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
IUPAC Name:
4-methyl-2-(methylamino)benzaldehyde
InChI:
InChI=1S/C9H11NO/c1-7-3-4-8(6-11)9(5-7)10-2/h3-6,10H,1-2H3
InChI Key:
QBCKQWYIXVJVCW-UHFFFAOYSA-N
SMILES:
CNc1cc(C)ccc1C=O
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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