1-Benzhydryl-3-(methoxymethyl)azetidine - CAS 955400-19-8

Catalog:	BB041757
Product Name:	1-Benzhydryl-3-(methoxymethyl)azetidine
CAS:	955400-19-8
Synonyms:	1-(diphenylmethyl)-3-(methoxymethyl)azetidine; 1-benzhydryl-3-(methoxymethyl)azetidine

Technical Data

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Computed Properties

IUPAC Name:	1-benzhydryl-3-(methoxymethyl)azetidine
Description:	1-Benzhydryl-3-(methoxymethyl)azetidine (CAS# 955400-19-8 ) is a useful research chemical.
Molecular Weight:	267.37
Molecular Formula:	C18H21NO
Canonical SMILES:	COCC1CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI:	InChI=1S/C18H21NO/c1-20-14-15-12-19(13-15)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,15,18H,12-14H2,1H3
InChI Key:	UZMOKQUZHHAIAG-UHFFFAOYSA-N
Boiling Point:	347.0±22.0 °C (760 mmHg)
Density:	1.077±0.06 g/cm³(20 °C , 760mmH g)
LogP:	3.29210

Publication Number	Title	Priority Date
US-8952169-B2	N-substituted benzamides and methods of use thereof	20120522
AU-2008331163-A1	Phosphonic acid derivates and their use as P2Y12 receptor antagonists	20071129
AU-2008331163-B2	Phosphonic acid derivates and their use as P2Y12 receptor antagonists	20071129
CA-2706475-A1	Phosphonic acid derivates and their use as p2y12 receptor antagonists	20071129
EP-2225253-A1	Phosphonic acid derivates and their use as p2y12 receptor antagonists	20071129

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Complexity:	257
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	267.162314293
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	267.162314293
Rotatable Bond Count:	5
Topological Polar Surface Area:	12.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3