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Home > Indoles and Oxindole > 95538-31-1
95538-31-1 | 1H-Indole-2-carbonylchloride, 5-methyl-
CAS No: 95538-31-1 Catalog No: AG006CN2 MDL No:MFCD11617054
Product Description
Catalog Number:
AG006CN2
Chemical Name:
1H-Indole-2-carbonylchloride, 5-methyl-
CAS Number:
95538-31-1
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
MDL Number:
MFCD11617054
IUPAC Name:
5-methyl-1H-indole-2-carbonyl chloride
InChI:
InChI=1S/C10H8ClNO/c1-6-2-3-8-7(4-6)5-9(12-8)10(11)13/h2-5,12H,1H3
InChI Key:
RIHSEHIILZGQRQ-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)cc([nH]2)C(=O)Cl
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.029g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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