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183066-67-3 | tert-butyl N-{[5-(hydroxymethyl)-1,3-thiazol-2-yl]methyl}carbamate
CAS No: 183066-67-3 Catalog No: AG01EMR7 MDL No:MFCD31381024
Product Description
Catalog Number:
AG01EMR7
Chemical Name:
tert-butyl N-{[5-(hydroxymethyl)-1,3-thiazol-2-yl]methyl}carbamate
CAS Number:
183066-67-3
Molecular Formula:
C10H16N2O3S
Molecular Weight:
244.3106
MDL Number:
MFCD31381024
IUPAC Name:
tert-butyl N-[[5-(hydroxymethyl)-1,3-thiazol-2-yl]methyl]carbamate
InChI:
InChI=1S/C10H16N2O3S/c1-10(2,3)15-9(14)12-5-8-11-4-7(6-13)16-8/h4,13H,5-6H2,1-3H3,(H,12,14)
InChI Key:
XSEMBOMSMMUQQV-UHFFFAOYSA-N
SMILES:
OCc1cnc(s1)CNC(=O)OC(C)(C)C
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.088g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.309g/mol
Monoisotopic Mass:
244.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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