Home Halogens (Z)-ethyl 3-aMino-4,4,4-trichloro-2-cyanobut-2-enoate

(Z)-ethyl 3-aMino-4,4,4-trichloro-2-cyanobut-2-enoate

CAS No.:
49765-05-1
Catalog Number:
AG00E3MS
Molecular Formula:
C7H7Cl3N2O2
Molecular Weight:
257.5017
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$51
- +
250mg
95%
In Stock USA
United States
$93
- +
1g
95%
In Stock USA
United States
$185
- +
5g
95%
In Stock USA
United States
$555
- +
Product Description
Catalog Number:
AG00E3MS
Chemical Name:
(Z)-ethyl 3-aMino-4,4,4-trichloro-2-cyanobut-2-enoate
CAS Number:
49765-05-1
Molecular Formula:
C7H7Cl3N2O2
Molecular Weight:
257.5017
MDL Number:
MFCD00181228
IUPAC Name:
ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate
InChI:
InChI=1S/C7H7Cl3N2O2/c1-2-14-6(13)4(3-11)5(12)7(8,9)10/h2,12H2,1H3/b5-4-
InChI Key:
KYTOUGMOZGVXTJ-PLNGDYQASA-N
SMILES:
CCOC(=O)/C(=C(/C(Cl)(Cl)Cl)\N)/C#N
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
255.957g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.495g/mol
Monoisotopic Mass:
255.957g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties