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Home > Thiazole > 1803588-74-0
1803588-74-0 | 2-(methoxymethyl)-5-phenyl-1,3-thiazole-4-carbonitrile
CAS No: 1803588-74-0 Catalog No: AG01BHE9 MDL No:MFCD28145263
Product Description
Catalog Number:
AG01BHE9
Chemical Name:
2-(methoxymethyl)-5-phenyl-1,3-thiazole-4-carbonitrile
CAS Number:
1803588-74-0
Molecular Formula:
C12H10N2OS
Molecular Weight:
230.2856
MDL Number:
MFCD28145263
IUPAC Name:
2-(methoxymethyl)-5-phenyl-1,3-thiazole-4-carbonitrile
InChI:
InChI=1S/C12H10N2OS/c1-15-8-11-14-10(7-13)12(16-11)9-5-3-2-4-6-9/h2-6H,8H2,1H3
InChI Key:
CWIYXRGUEUUVNM-UHFFFAOYSA-N
SMILES:
COCc1nc(c(s1)c1ccccc1)C#N
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.285g/mol
Monoisotopic Mass:
230.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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