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116945-47-2 | Oxetane, 3-methyl-3-[(phenylmethoxy)methyl]-
CAS No: 116945-47-2 Catalog No: AG000DF8 MDL No:
Product Description
Catalog Number:
AG000DF8
Chemical Name:
Oxetane, 3-methyl-3-[(phenylmethoxy)methyl]-
CAS Number:
116945-47-2
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
IUPAC Name:
3-methyl-3-(phenylmethoxymethyl)oxetane
InChI:
InChI=1S/C12H16O2/c1-12(9-14-10-12)8-13-7-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChI Key:
NLEVDEHAYUDSSH-UHFFFAOYSA-N
SMILES:
CC1(COCc2ccccc2)COC1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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