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51077-16-8 | Boc-Thz-OH
CAS No: 51077-16-8 Catalog No: AG003OHI MDL No:MFCD00077002
Product Description
Catalog Number:
AG003OHI
Chemical Name:
Boc-Thz-OH
CAS Number:
51077-16-8
Molecular Formula:
C9H15NO4S
Molecular Weight:
233.2847
MDL Number:
MFCD00077002
IUPAC Name:
(4R)-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-thiazolidine-4-carboxylic acid
InChI:
InChI=1S/C9H15NO4S/c1-9(2,3)14-8(13)10-5-15-4-6(10)7(11)12/h6H,4-5H2,1-3H3,(H,11,12)/t6-/m0/s1
InChI Key:
FJWNZTPXVSWUKF-LURJTMIESA-N
SMILES:
O=C(N1CSC[C@H]1C(=O)O)OC(C)(C)C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
233.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.282g/mol
Monoisotopic Mass:
233.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
92.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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