Home Carboxys ethyl 1-hydroxy-3,3-dimethylcyclobutane-1-carboxylate

ethyl 1-hydroxy-3,3-dimethylcyclobutane-1-carboxylate

CAS No.:
1936340-44-1
Catalog Number:
AG01DZ87
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
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Product Description
Catalog Number:
AG01DZ87
Chemical Name:
ethyl 1-hydroxy-3,3-dimethylcyclobutane-1-carboxylate
CAS Number:
1936340-44-1
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
IUPAC Name:
ethyl 1-hydroxy-3,3-dimethylcyclobutane-1-carboxylate
InChI:
InChI=1S/C9H16O3/c1-4-12-7(10)9(11)5-8(2,3)6-9/h11H,4-6H2,1-3H3
InChI Key:
YZRWIELXIQIRBP-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(O)CC(C1)(C)C
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.11g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.224g/mol
Monoisotopic Mass:
172.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties