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1326236-62-7 | tert-butyl N-(5-iodo-1,3-thiazol-2-yl)carbamate
CAS No: 1326236-62-7 Catalog No: AG01AMSM MDL No:MFCD11617302
Product Description
Catalog Number:
AG01AMSM
Chemical Name:
tert-butyl N-(5-iodo-1,3-thiazol-2-yl)carbamate
CAS Number:
1326236-62-7
Molecular Formula:
C8H11IN2O2S
Molecular Weight:
326.1546
MDL Number:
MFCD11617302
IUPAC Name:
tert-butyl N-(5-iodo-1,3-thiazol-2-yl)carbamate
InChI:
InChI=1S/C8H11IN2O2S/c1-8(2,3)13-7(12)11-6-10-4-5(9)14-6/h4H,1-3H3,(H,10,11,12)
InChI Key:
CYJTZVZDJQUKIE-UHFFFAOYSA-N
SMILES:
O=C(Nc1ncc(s1)I)OC(C)(C)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.959g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
326.152g/mol
Monoisotopic Mass:
325.959g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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