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Home Halogens tert-Butyl (5-bromobenzo[d][1,3]dioxol-4-yl)carbamate

tert-Butyl (5-bromobenzo[d][1,3]dioxol-4-yl)carbamate

CAS No.:
401811-77-6
Catalog Number:
AG00CAJF
Molecular Formula:
C12H14BrNO4
Molecular Weight:
316.1479
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95+%
1 week
United States
$103
- +
250mg
95+%
1 week
United States
$194
- +
Product Description
Catalog Number:
AG00CAJF
Chemical Name:
tert-Butyl (5-bromobenzo[d][1,3]dioxol-4-yl)carbamate
CAS Number:
401811-77-6
Molecular Formula:
C12H14BrNO4
Molecular Weight:
316.1479
MDL Number:
MFCD09038120
IUPAC Name:
tert-butyl N-(5-bromo-1,3-benzodioxol-4-yl)carbamate
InChI:
InChI=1S/C12H14BrNO4/c1-12(2,3)18-11(15)14-9-7(13)4-5-8-10(9)17-6-16-8/h4-5H,6H2,1-3H3,(H,14,15)
InChI Key:
JMDLHOQJZIIQMX-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1c(Br)ccc2c1OCO2
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.011g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.151g/mol
Monoisotopic Mass:
315.011g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties