Home Halogens tert-Butyl (2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazol-6-yl)carbamate

tert-Butyl (2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazol-6-yl)carbamate

CAS No.:
1251009-79-6
Catalog Number:
AG009W5T
Molecular Formula:
C12H17BrN2O2S
Molecular Weight:
333.2446
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$569
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Product Description
Catalog Number:
AG009W5T
Chemical Name:
tert-Butyl (2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazol-6-yl)carbamate
CAS Number:
1251009-79-6
Molecular Formula:
C12H17BrN2O2S
Molecular Weight:
333.2446
MDL Number:
MFCD27918568
IUPAC Name:
tert-butyl N-(2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)carbamate
InChI:
InChI=1S/C12H17BrN2O2S/c1-12(2,3)17-11(16)14-7-4-5-8-9(6-7)18-10(13)15-8/h7H,4-6H2,1-3H3,(H,14,16)
InChI Key:
IYHSCTMUOVWIJY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCc2c(C1)sc(n2)Br
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.019g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
333.244g/mol
Monoisotopic Mass:
332.019g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties