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Home > Aldehydes > 1824297-85-9
1824297-85-9 | 6-METHYLISOQUINOLINE-5-CARBALDEHYDE
CAS No: 1824297-85-9 Catalog No: AG01BO88 MDL No:MFCD22394862
Product Description
Catalog Number:
AG01BO88
Chemical Name:
6-METHYLISOQUINOLINE-5-CARBALDEHYDE
CAS Number:
1824297-85-9
Molecular Formula:
C11H9NO
Molecular Weight:
171.1953
MDL Number:
MFCD22394862
IUPAC Name:
6-methylisoquinoline-5-carbaldehyde
InChI:
InChI=1S/C11H9NO/c1-8-2-3-9-6-12-5-4-10(9)11(8)7-13/h2-7H,1H3
InChI Key:
UHVBOOSHMCXWMN-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)ccc2c1ccnc2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.199g/mol
Monoisotopic Mass:
171.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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