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125735-40-2 | Azetidine, 1-(diphenylmethyl)-3-iodo-
CAS No: 125735-40-2 Catalog No: AG000OL1 MDL No:MFCD08062427
Product Description
Catalog Number:
AG000OL1
Chemical Name:
Azetidine, 1-(diphenylmethyl)-3-iodo-
CAS Number:
125735-40-2
Molecular Formula:
C16H16IN
Molecular Weight:
349.2094
MDL Number:
MFCD08062427
IUPAC Name:
1-benzhydryl-3-iodoazetidine
InChI:
InChI=1S/C16H16IN/c17-15-11-18(12-15)16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChI Key:
IBCVAYQWXMWFLD-UHFFFAOYSA-N
SMILES:
IC1CN(C1)C(c1ccccc1)c1ccccc1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.033g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.215g/mol
Monoisotopic Mass:
349.033g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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