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Home > Thiazole > 1443980-47-9
1443980-47-9 | tert-butyl N-[cyano(2-methyl-1,3-thiazol-4-yl)methyl]carbamate
CAS No: 1443980-47-9 Catalog No: AG01A59F MDL No:MFCD24842833
Product Description
Catalog Number:
AG01A59F
Chemical Name:
tert-butyl N-[cyano(2-methyl-1,3-thiazol-4-yl)methyl]carbamate
CAS Number:
1443980-47-9
Molecular Formula:
C11H15N3O2S
Molecular Weight:
253.3207
MDL Number:
MFCD24842833
IUPAC Name:
tert-butyl N-[cyano-(2-methyl-1,3-thiazol-4-yl)methyl]carbamate
InChI:
InChI=1S/C11H15N3O2S/c1-7-13-9(6-17-7)8(5-12)14-10(15)16-11(2,3)4/h6,8H,1-4H3,(H,14,15)
InChI Key:
BWQMKHDXHWTISG-UHFFFAOYSA-N
SMILES:
N#CC(c1csc(n1)C)NC(=O)OC(C)(C)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.088g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.32g/mol
Monoisotopic Mass:
253.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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