N-Benzyl-4-aminotetrahydropyran - CAS 443344-23-8

Catalog:	BB025569
Product Name:	N-Benzyl-4-aminotetrahydropyran
CAS:	443344-23-8
Synonyms:	N-(phenylmethyl)-4-oxanamine; N-benzyloxan-4-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	N-benzyloxan-4-amine
Description:	N-Benzyl-4-aminotetrahydropyran (CAS# 443344-23-8) is a useful research chemical.
Molecular Weight:	191.27
Molecular Formula:	C12H17NO
Canonical SMILES:	C1COCCC1NCC2=CC=CC=C2
InChI:	InChI=1S/C12H17NO/c1-2-4-11(5-3-1)10-13-12-6-8-14-9-7-12/h1-5,12-13H,6-10H2
InChI Key:	NLTUORBOSAQIDV-UHFFFAOYSA-N
MDL:	MFCD11035934
LogP:	2.34610

Publication Number	Title	Priority Date
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Complexity:	148
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.131014166
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.131014166
Rotatable Bond Count:	3
Topological Polar Surface Area:	21.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7