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Home > Aldehydes > 119491-08-6
119491-08-6 | 1-PROPYL-1H-INDOLE-3-CARBALDEHYDE
CAS No: 119491-08-6 Catalog No: AG008SBU MDL No:MFCD03905843
Product Description
Catalog Number:
AG008SBU
Chemical Name:
1-PROPYL-1H-INDOLE-3-CARBALDEHYDE
CAS Number:
119491-08-6
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD03905843
IUPAC Name:
1-propylindole-3-carbaldehyde
InChI:
InChI=1S/C12H13NO/c1-2-7-13-8-10(9-14)11-5-3-4-6-12(11)13/h3-6,8-9H,2,7H2,1H3
InChI Key:
YVQNEXSVVNEUGR-UHFFFAOYSA-N
SMILES:
CCCn1cc(c2c1cccc2)C=O
Properties
Complexity:
205
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:
3
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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