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1019546-78-1 | 2-(cyclopropylmethoxy)pyridine-4-carbothioamide
CAS No: 1019546-78-1 Catalog No: AG00IMP9 MDL No:MFCD11136716
Product Description
Catalog Number:
AG00IMP9
Chemical Name:
2-(cyclopropylmethoxy)pyridine-4-carbothioamide
CAS Number:
1019546-78-1
Molecular Formula:
C10H12N2OS
Molecular Weight:
208.2801
MDL Number:
MFCD11136716
IUPAC Name:
2-(cyclopropylmethoxy)pyridine-4-carbothioamide
InChI:
InChI=1S/C10H12N2OS/c11-10(14)8-3-4-12-9(5-8)13-6-7-1-2-7/h3-5,7H,1-2,6H2,(H2,11,14)
InChI Key:
WSGSPSNQKWDXEZ-UHFFFAOYSA-N
SMILES:
NC(=S)c1ccnc(c1)OCC1CC1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.279g/mol
Monoisotopic Mass:
208.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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