Home Other Building Blocks 4-CYCLOBUTYL-2,4-DIOXO-BUTYRIC ACID ETHYL ESTER

4-CYCLOBUTYL-2,4-DIOXO-BUTYRIC ACID ETHYL ESTER

CAS No.:
1222955-59-0
Catalog Number:
AG01EIMC
Molecular Formula:
C10H14O4
Molecular Weight:
198.2158
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Product Description
Catalog Number:
AG01EIMC
Chemical Name:
4-CYCLOBUTYL-2,4-DIOXO-BUTYRIC ACID ETHYL ESTER
CAS Number:
1222955-59-0
Molecular Formula:
C10H14O4
Molecular Weight:
198.2158
MDL Number:
MFCD29047832
IUPAC Name:
ethyl 4-cyclobutyl-2,4-dioxobutanoate
InChI:
InChI=1S/C10H14O4/c1-2-14-10(13)9(12)6-8(11)7-4-3-5-7/h7H,2-6H2,1H3
InChI Key:
QHIAUQJBVQTXSM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)CC(=O)C1CCC1
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.089g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.218g/mol
Monoisotopic Mass:
198.089g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties