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Home > Pyridines > 864266-67-1
864266-67-1 | 6-(tert-butylsulfanyl)pyridine-3-carbonitrile
CAS No: 864266-67-1 Catalog No: AG01A1LV MDL No:MFCD11136356
Product Description
Catalog Number:
AG01A1LV
Chemical Name:
6-(tert-butylsulfanyl)pyridine-3-carbonitrile
CAS Number:
864266-67-1
Molecular Formula:
C10H12N2S
Molecular Weight:
192.2807
MDL Number:
MFCD11136356
IUPAC Name:
6-tert-butylsulfanylpyridine-3-carbonitrile
InChI:
InChI=1S/C10H12N2S/c1-10(2,3)13-9-5-4-8(6-11)7-12-9/h4-5,7H,1-3H3
InChI Key:
DRFBXSPWXKIADQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)SC(C)(C)C
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.28g/mol
Monoisotopic Mass:
192.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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