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Home > Aldehydes > 133994-99-7
133994-99-7 | 1-Methyl-1H-indole-4-carbaldehyde
CAS No: 133994-99-7 Catalog No: AG00804R MDL No:MFCD08690261
Product Description
Catalog Number:
AG00804R
Chemical Name:
1-Methyl-1H-indole-4-carbaldehyde
CAS Number:
133994-99-7
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD08690261
IUPAC Name:
1-methylindole-4-carbaldehyde
InChI:
InChI=1S/C10H9NO/c1-11-6-5-9-8(7-12)3-2-4-10(9)11/h2-7H,1H3
InChI Key:
GFTNSZIYQMJJMD-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1ccn2C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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