Home Aminos Ethyl 4-(cyclopropylamino)-3-nitrobenzoate

Ethyl 4-(cyclopropylamino)-3-nitrobenzoate

CAS No.:
1467047-28-4
Catalog Number:
AG00HXIL
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$219
- +
5g
98%
In Stock USA
United States
$844
- +
Product Description
Catalog Number:
AG00HXIL
Chemical Name:
Ethyl 4-(cyclopropylamino)-3-nitrobenzoate
CAS Number:
1467047-28-4
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
MDL Number:
MFCD14635824
IUPAC Name:
ethyl 4-(cyclopropylamino)-3-nitrobenzoate
InChI:
InChI=1S/C12H14N2O4/c1-2-18-12(15)8-3-6-10(13-9-4-5-9)11(7-8)14(16)17/h3,6-7,9,13H,2,4-5H2,1H3
InChI Key:
XPGCSHFQVYOFRG-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c(c1)[N+](=O)[O-])NC1CC1
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.254g/mol
Monoisotopic Mass:
250.095g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties