Home Nitriles 3-methoxy-1,2-thiazole-5-carbonitrile

3-methoxy-1,2-thiazole-5-carbonitrile

CAS No.:
1909317-29-8
Catalog Number:
AG01C49M
Molecular Formula:
C5H4N2OS
Molecular Weight:
140.1631
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Product Description
Catalog Number:
AG01C49M
Chemical Name:
3-methoxy-1,2-thiazole-5-carbonitrile
CAS Number:
1909317-29-8
Molecular Formula:
C5H4N2OS
Molecular Weight:
140.1631
MDL Number:
MFCD29763064
IUPAC Name:
3-methoxy-1,2-thiazole-5-carbonitrile
InChI:
InChI=1S/C5H4N2OS/c1-8-5-2-4(3-6)9-7-5/h2H,1H3
InChI Key:
DTIKLZLBJRXSCH-UHFFFAOYSA-N
SMILES:
COc1nsc(c1)C#N
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.004g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.16g/mol
Monoisotopic Mass:
140.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties