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Mevalonic Lactone Methacrylate

CAT: 0926-CHA08066Size: 1 gDry Ice: NoHazardous: No
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CAT#:0926-CHA08066Size:1 g
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CAS Number
177080-66-9
MDL Number
MFCD22581441
Smiles
CC (=C) C (=O) OC1 (CCOC (=O) C1) C
Molecular Formula
C10H14O4
Molecular Weight
198.22 g/mol
Controlled
No

Chemical Information

Mevalonic Lactone Methacrylate
CAS Number177080-66-9
PubChem CID9964364
IUPAC Name(4-methyl-2-oxooxan-4-yl) 2-methylprop-2-enoate
Molecular FormulaC10H14O4
Molecular Weight198.22
XLogP1.3
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count14
Formal Charge0
Complexity282
SMILES
CC(=C)C(=O)OC1(CCOC(=O)C1)C
InChI
InChI=1S/C10H14O4/c1-7(2)9(12)14-10(3)4-5-13-8(11)6-10/h1,4-6H2,2-3H3
InChIKey
JANRUIBBIKVUHU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mevalonic Lactone Methacrylate
CAS: 177080-66-9
CID: 9964364
Formula: C10H14O4
MW: 198.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight198.22
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass198.08920892
Monoisotopic Mass198.08920892
Topological Polar Surface Area52.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity282
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes