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67707-09-9 | 9-BUTYL-9H-CARBAZOLE-3-CARBALDEHYDE
CAS No: 67707-09-9 Catalog No: AG005QL1 MDL No:
Product Description
Catalog Number:
AG005QL1
Chemical Name:
9-BUTYL-9H-CARBAZOLE-3-CARBALDEHYDE
CAS Number:
67707-09-9
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
IUPAC Name:
9-butylcarbazole-3-carbaldehyde
InChI:
InChI=1S/C17H17NO/c1-2-3-10-18-16-7-5-4-6-14(16)15-11-13(12-19)8-9-17(15)18/h4-9,11-12H,2-3,10H2,1H3
InChI Key:
MNLZGFHCFGWITO-UHFFFAOYSA-N
SMILES:
CCCCn1c2ccccc2c2c1ccc(c2)C=O
EC Number:
266-958-9
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.329g/mol
Monoisotopic Mass:
251.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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