RefChem:1094875

(E)-but-2-enedioic acid;bis(3-[1-(cyclopropylmethyl)-3,6-dihydro-2H-pyridin-5-yl]phenol)

Also Known As: 3-(1-Cyclopropylmethyl-1,2,5,6-tetrahydropyridin-3-yl)phenol fumarate|3-[1-(Cyclopropylmethyl)-1,2,5,6-tetrahydro-3-pyridinyl]phen|Phenol, 3-(1-(cyclopropylmethyl)-1,2,5,6-tetrahydro-3-pyridinyl)-, (E)-2- butenedioate (2:1) (salt)|(E)-but-2-enedioic acid; 3-[1-(cyclopropylmethyl)-3,6-dihydro-2H-pyridin-5-yl]phenol|3-[1-(Cyclopropylmethyl)-1,2,5,6-tetrahydro-3-pyridinyl]phenol (2 E)-2-butenedioate (2:1)|Phenol, 3-(1-(cyclopropylmethyl)-1,2,5,6-tetrahydro-3-pyridinyl)-, (E)-2-butenedioate (2:1) (salt)

Molecular Formula	C34H42N2O6
Molecular Weight	574.30426 g/mol
LogP	5.4944
Topological Polar Surface Area	121.54 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	574.30426
Monoisotopic Mass	574.30426
Heavy Atoms	42
Complexity	1209.1154

Chemical Identifiers

CAS Number	83010-56-4
SMILES	C1CN(CC(=C1)C2=CC(=CC=C2)O)CC3CC3.C1CN(CC(=C1)C2=CC(=CC=C2)O)CC3CC3.C(=C/C(=O)O)\C(=O)O