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1796-37-8 | Indole-2-carboxaldehyde, 7-methyl- (7CI,8CI)
CAS No: 1796-37-8 Catalog No: AG00B3L8 MDL No:MFCD06801044
Product Description
Catalog Number:
AG00B3L8
Chemical Name:
Indole-2-carboxaldehyde, 7-methyl- (7CI,8CI)
CAS Number:
1796-37-8
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD06801044
IUPAC Name:
7-methyl-1H-indole-2-carbaldehyde
InChI:
InChI=1S/C10H9NO/c1-7-3-2-4-8-5-9(6-12)11-10(7)8/h2-6,11H,1H3
InChI Key:
WEAKVBPGCWZRSD-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c([nH]1)c(C)ccc2
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:
1
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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