1-methyl-4-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]-1,4-diazepane

CAS: 75842-92-1

Molecular Formula	`C22H30N2O`
Molecular Weight	338.5 g/mol
LogP	3.8
Topological Polar Surface Area	15.7 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	338.2358
Heavy Atoms	25
Complexity	361.0

Chemical Identifiers

CAS Number	75842-92-1
SMILES	`CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCCN3CCCN(CC3)C`
InChIKey	`CTDVPTSYTXVMPY-UHFFFAOYSA-N`

📖 Product Overview

1-methyl-4-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]-1,4-diazepane (CAS: 75842-92-1) is a chemical compound with molecular formula C22H30N2O and molecular weight 338.5 g/mol. Its IUPAC systematic name is 1-methyl-4-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]-1,4-diazepane. LogP 3.8 Topological Polar Surface Area 15.7 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 338.2358 Heavy Atoms 25 Complexity 361.0 InChI Key: CTDVPTSYTXVMPY-UHFFFAOYSA-N. SMILES: CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCCN3CCCN(CC3)C.

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