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1003013-76-0 | Oxetane, 3-[(phenylmethoxy)methyl]-
CAS No: 1003013-76-0 Catalog No: AG0001IS MDL No:MFCD20482348
Product Description
Catalog Number:
AG0001IS
Chemical Name:
Oxetane, 3-[(phenylmethoxy)methyl]-
CAS Number:
1003013-76-0
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD20482348
IUPAC Name:
3-(phenylmethoxymethyl)oxetane
InChI:
InChI=1S/C11H14O2/c1-2-4-10(5-3-1)6-12-7-11-8-13-9-11/h1-5,11H,6-9H2
InChI Key:
KUTKSFHVQSBUNA-UHFFFAOYSA-N
SMILES:
O(Cc1ccccc1)CC1COC1
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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