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Home > Indoles and Oxindole > 316829-38-6
316829-38-6 | 2,3,3-trimethyl-3H-indole-5-sulfonyl chloride
CAS No: 316829-38-6 Catalog No: AG01AFQ4 MDL No:MFCD27500969
Product Description
Catalog Number:
AG01AFQ4
Chemical Name:
2,3,3-trimethyl-3H-indole-5-sulfonyl chloride
CAS Number:
316829-38-6
Molecular Formula:
C11H12ClNO2S
Molecular Weight:
257.7365
MDL Number:
MFCD27500969
IUPAC Name:
2,3,3-trimethylindole-5-sulfonyl chloride
InChI:
InChI=1S/C11H12ClNO2S/c1-7-11(2,3)9-6-8(16(12,14)15)4-5-10(9)13-7/h4-6H,1-3H3
InChI Key:
VQSNLVAYNDFHID-UHFFFAOYSA-N
SMILES:
CC1=Nc2c(C1(C)C)cc(cc2)S(=O)(=O)Cl
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.028g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.732g/mol
Monoisotopic Mass:
257.028g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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