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Home > Aldehydes > 823236-19-7
823236-19-7 | 7-Isoquinolinecarboxaldehyde, 3,4-dihydro-1-methyl-
CAS No: 823236-19-7 Catalog No: AG00543B MDL No:MFCD13179409
Product Description
Catalog Number:
AG00543B
Chemical Name:
7-Isoquinolinecarboxaldehyde, 3,4-dihydro-1-methyl-
CAS Number:
823236-19-7
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD13179409
IUPAC Name:
1-methyl-3,4-dihydroisoquinoline-7-carbaldehyde
InChI:
InChI=1S/C11H11NO/c1-8-11-6-9(7-13)2-3-10(11)4-5-12-8/h2-3,6-7H,4-5H2,1H3
InChI Key:
UFSBRXMPVXJAGS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)C(=NCC2)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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