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28562-61-0 | 3-Oxetanecarboxylic acid, 3-ethyl-
CAS No: 28562-61-0 Catalog No: AG002VPL MDL No:MFCD12024538
Product Description
Catalog Number:
AG002VPL
Chemical Name:
3-Oxetanecarboxylic acid, 3-ethyl-
CAS Number:
28562-61-0
Molecular Formula:
C6H10O3
Molecular Weight:
130.1418
MDL Number:
MFCD12024538
IUPAC Name:
3-ethyloxetane-3-carboxylic acid
InChI:
InChI=1S/C6H10O3/c1-2-6(5(7)8)3-9-4-6/h2-4H2,1H3,(H,7,8)
InChI Key:
MVJXOACCRTZVJY-UHFFFAOYSA-N
SMILES:
CCC1(COC1)C(=O)O
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.063g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.143g/mol
Monoisotopic Mass:
130.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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