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154953-78-3

154953-78-3 | 2(3H)-Furanone, 3-(1-chloroethylidene)-4-ethenyldihydro-, (3E)-

CAS No: 154953-78-3 Catalog No: AG001NHZ MDL No:

Product Description

Catalog Number:
AG001NHZ
Chemical Name:
2(3H)-Furanone, 3-(1-chloroethylidene)-4-ethenyldihydro-, (3E)-
CAS Number:
154953-78-3
Molecular Formula:
C8H9ClO2
Molecular Weight:
172.6089
IUPAC Name:
3-(1-chloroethylidene)-4-ethenyloxolan-2-one
InChI:
InChI=1S/C8H9ClO2/c1-3-6-4-11-8(10)7(6)5(2)9/h3,6H,1,4H2,2H3
InChI Key:
XGSKBJKWCFEVNC-UHFFFAOYSA-N
SMILES:
C/C(=C\1/C(COC1=O)C=C)/Cl

Properties

Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.029g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.608g/mol
Monoisotopic Mass:
172.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2  

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