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Home > Aldehydes > 1090903-87-9
1090903-87-9 | 1-ETHYL-4-METHYL-1H-INDOLE-3-CARBALDEHYDE
CAS No: 1090903-87-9 Catalog No: AG01BZ6S MDL No:MFCD15523365
Product Description
Catalog Number:
AG01BZ6S
Chemical Name:
1-ETHYL-4-METHYL-1H-INDOLE-3-CARBALDEHYDE
CAS Number:
1090903-87-9
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD15523365
IUPAC Name:
1-ethyl-4-methylindole-3-carbaldehyde
InChI:
InChI=1S/C12H13NO/c1-3-13-7-10(8-14)12-9(2)5-4-6-11(12)13/h4-8H,3H2,1-2H3
InChI Key:
IBNXPCUTBBRJKJ-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1c(C)ccc2)CC
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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