Home Other Building Blocks 2-Ethoxyethyl cyanoacetate

2-Ethoxyethyl cyanoacetate

CAS No.:
32804-77-6
Catalog Number:
AG003H6F
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$37
- +
25g
98%
In Stock USA
United States
$69
- +
100g
98%
In Stock USA
United States
$186
- +
500g
98%
In Stock USA
United States
$463
- +
Product Description
Catalog Number:
AG003H6F
Chemical Name:
2-Ethoxyethyl cyanoacetate
CAS Number:
32804-77-6
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
MDL Number:
MFCD00071546
IUPAC Name:
2-ethoxyethyl 2-cyanoacetate
InChI:
InChI=1S/C7H11NO3/c1-2-10-5-6-11-7(9)3-4-8/h2-3,5-6H2,1H3
InChI Key:
UMCLCZMPTREESK-UHFFFAOYSA-N
SMILES:
CCOCCOC(=O)CC#N
EC Number:
251-228-4
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
2-Eth-oxy-ethyl (Z)-2-cyano-3-[(N-phenyl-carbamo-yl)amino]-prop-2-enoate. Acta crystallographica. Section E, Structure reports online 20120201
Properties