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126921-19-5

126921-19-5 | 1H-Indole-3-carbonyl chloride, 1-methyl-

CAS No: 126921-19-5 Catalog No: AG000TGT MDL No:

Product Description

Catalog Number:
AG000TGT
Chemical Name:
1H-Indole-3-carbonyl chloride, 1-methyl-
CAS Number:
126921-19-5
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
IUPAC Name:
1-methylindole-3-carbonyl chloride
InChI:
InChI=1S/C10H8ClNO/c1-12-6-8(10(11)13)7-4-2-3-5-9(7)12/h2-6H,1H3
InChI Key:
MCDFXFLLOVQTLA-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cn(c2c1cccc2)C

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:
0
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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