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876756-13-7 | tert-Butyl (4-(2-hydroxypropan-2-yl)thiazol-2-yl)carbamate
CAS No: 876756-13-7 Catalog No: AG008E0Z MDL No:MFCD16878877
Product Description
Catalog Number:
AG008E0Z
Chemical Name:
tert-Butyl (4-(2-hydroxypropan-2-yl)thiazol-2-yl)carbamate
CAS Number:
876756-13-7
Molecular Formula:
C11H18N2O3S
Molecular Weight:
258.3372
MDL Number:
MFCD16878877
IUPAC Name:
tert-butyl N-[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]carbamate
InChI:
InChI=1S/C11H18N2O3S/c1-10(2,3)16-9(14)13-8-12-7(6-17-8)11(4,5)15/h6,15H,1-5H3,(H,12,13,14)
InChI Key:
BFIZWPAPXCCVPQ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1scc(n1)C(O)(C)C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.104g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.336g/mol
Monoisotopic Mass:
258.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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