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1221819-46-0 | Oxetane, 3-[(phenylsulfonyl)methylene]-
CAS No: 1221819-46-0 Catalog No: AG0016WH MDL No:MFCD16652327
Product Description
Catalog Number:
AG0016WH
Chemical Name:
Oxetane, 3-[(phenylsulfonyl)methylene]-
CAS Number:
1221819-46-0
Molecular Formula:
C10H10O3S
Molecular Weight:
210.2496
MDL Number:
MFCD16652327
IUPAC Name:
3-(benzenesulfonylmethylidene)oxetane
InChI:
InChI=1S/C10H10O3S/c11-14(12,8-9-6-13-7-9)10-4-2-1-3-5-10/h1-5,8H,6-7H2
InChI Key:
NCHCTLRZIXTLPI-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)C=C1COC1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.247g/mol
Monoisotopic Mass:
210.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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