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17793-53-2 | Oxirane, 2-[(2-buten-1-yloxy)methyl]-
CAS No: 17793-53-2 Catalog No: AG0025MH MDL No:
Product Description
Catalog Number:
AG0025MH
Chemical Name:
Oxirane, 2-[(2-buten-1-yloxy)methyl]-
CAS Number:
17793-53-2
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
IUPAC Name:
2-(but-2-enoxymethyl)oxirane
InChI:
InChI=1S/C7H12O2/c1-2-3-4-8-5-7-6-9-7/h2-3,7H,4-6H2,1H3
InChI Key:
WLRSFKOXUMHAFS-UHFFFAOYSA-N
SMILES:
CC=CCOCC1CO1
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
0.6
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