Home Other Building Blocks Diethyl trans-3-Hexenedioate

Diethyl trans-3-Hexenedioate

CAS No.:
57042-08-7
Catalog Number:
AG00EF69
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
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Product Description
Catalog Number:
AG00EF69
Chemical Name:
Diethyl trans-3-Hexenedioate
CAS Number:
57042-08-7
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
MDL Number:
MFCD00191608
IUPAC Name:
diethyl (E)-hex-3-enedioate
InChI:
InChI=1S/C10H16O4/c1-3-13-9(11)7-5-6-8-10(12)14-4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5+
InChI Key:
YIDKJPKYCLMJQW-AATRIKPKSA-N
SMILES:
CCOC(=O)C/C=C/CC(=O)OCC
NSC Number:
99233
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
200.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.234g/mol
Monoisotopic Mass:
200.105g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties