Home Halogens Isobutyl 3,5-diamino-4-chloro benzoate

Isobutyl 3,5-diamino-4-chloro benzoate

CAS No.:
32961-44-7
Catalog Number:
AG003R2G
Molecular Formula:
C11H15ClN2O2
Molecular Weight:
242.7020
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$32
- +
25g
98%
In Stock USA
United States
$82
- +
100g
98%
In Stock USA
United States
$244
- +
500g
98%
In Stock USA
United States
$875
- +
Product Description
Catalog Number:
AG003R2G
Chemical Name:
Isobutyl 3,5-diamino-4-chloro benzoate
CAS Number:
32961-44-7
Molecular Formula:
C11H15ClN2O2
Molecular Weight:
242.7020
MDL Number:
MFCD00272560
IUPAC Name:
2-methylpropyl 3,5-diamino-4-chlorobenzoate
InChI:
InChI=1S/C11H15ClN2O2/c1-6(2)5-16-11(15)7-3-8(13)10(12)9(14)4-7/h3-4,6H,5,13-14H2,1-2H3
InChI Key:
KHUIRIRTZCOEMK-UHFFFAOYSA-N
SMILES:
CC(COC(=O)c1cc(N)c(c(c1)N)Cl)C
EC Number:
251-311-5
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.082g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
242.703g/mol
Monoisotopic Mass:
242.082g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties