5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride

CAS

80866-74-6

Catalog Number

ACM80866746

Category

Main Products

Molecular Weight

245.75

Molecular Formula

C₁₅H₁₆ClN

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 279-577-8; 5,6,11,12-Tetrahydrodibenz(b,f)azocinium chloride; 5,6,11,12-tetrahydrobenzo[c][1]benzazocine hydrochloride; 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride; 5,6,11,12-tetrahydrodibenzo[b,f]azocine hydrochloride;

IUPAC Name

5,6,11,12-tetrahydrobenzo[c][1]benzazocine;hydrochloride

Canonical SMILES

C1CC2=CC=CC=C2NCC3=CC=CC=C31.Cl

InChI Key

UOKRHEQKLWSMMM-UHFFFAOYSA-N

Boiling Point

359.8ºC at 760 mmHg

Melting Point

233-234ºC

Flash Point

183.3ºC

Appearance

solid

EC Number

279-577-8

Exact Mass

245.09700

Safety Description

S24/25

What is the molecular formula of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The molecular formula is C15H16ClN.

What is the molecular weight of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The molecular weight is 245.74 g/mol.

What are the synonyms of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The synonyms are 80866-74-6, 5,6,11,12-Tetrahydrodibenz(b,f)azocinium chloride, EINECS 279-577-8.

What is the IUPAC name of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The IUPAC name is 5,6,11,12-tetrahydrobenzo[c][1]benzazocine;hydrochloride.

What is the InChI code of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The InChI code is InChI=1S/C15H15N.ClH/c1-2-7-14-11-16-15-8-4-3-6-13(15)10-9-12(14)5-1;/h1-8,16H,9-11H2;1H.

What is the InChIKey of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The InChIKey is UOKRHEQKLWSMMM-UHFFFAOYSA-N.

What is the Canonical SMILES of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The Canonical SMILES is C1CC2=CC=CC=C2NCC3=CC=CC=C31.Cl.

What is the CAS number of 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride?

The CAS number is 80866-74-6.

How many hydrogen bond donor counts does 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride have?

It has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 5,6,11,12-Tetrahydrodibenz[b,f]azocine hydrochloride have?

It has 1 hydrogen bond acceptor count.