Home Halogens tert-Butyl 4-chlorobenzoate

tert-Butyl 4-chlorobenzoate

CAS No.:
712-95-8
Catalog Number:
AG00IC5H
Molecular Formula:
C11H13ClO2
Molecular Weight:
212.6727
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$438
- +
5g
95%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00IC5H
Chemical Name:
tert-Butyl 4-chlorobenzoate
CAS Number:
712-95-8
Molecular Formula:
C11H13ClO2
Molecular Weight:
212.6727
MDL Number:
MFCD19600031
IUPAC Name:
tert-butyl 4-chlorobenzoate
InChI:
InChI=1S/C11H13ClO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h4-7H,1-3H3
InChI Key:
UKKZHZNQIFTSJN-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)OC(C)(C)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.06g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.673g/mol
Monoisotopic Mass:
212.06g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties