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Home > Aldehydes > 151409-84-6
151409-84-6 | 1H-Indole-3-carboxaldehyde, 1-(1-methylethyl)-
CAS No: 151409-84-6 Catalog No: AG001NBB MDL No:MFCD02629696
Product Description
Catalog Number:
AG001NBB
Chemical Name:
1H-Indole-3-carboxaldehyde, 1-(1-methylethyl)-
CAS Number:
151409-84-6
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD02629696
IUPAC Name:
1-propan-2-ylindole-3-carbaldehyde
InChI:
InChI=1S/C12H13NO/c1-9(2)13-7-10(8-14)11-5-3-4-6-12(11)13/h3-9H,1-2H3
InChI Key:
AEECOZTYVNXNDQ-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccc2)C(C)C
Properties
Complexity:
214
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:
2.2
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