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Structure

8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride

CAS
646477-45-4
Catalog Number
ACM646477454
Category
Organic Phosphine Compounds
Molecular Weight
213.15
Molecular Formula
C8H18Cl2N2

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Specification

Synonyms
8-methyl-8-azabicyclo[3.2.1]octan-3-amine Dihydrochloride, 646477-45-4, 8-methyl-8-aza-bicyclo[3.2.1]octan-3-aminedihydrochloride, AC1MCQL4, SureCN704299, SureCN3165611, CTK7D6034, MolPort-000-142-079, BTB14320, ANW-45680, RW2218, AKOS015901247, AG-A-93033, AG-G-42713, MCULE-2439448073, RP04864, AK-35979, KB-74262, AB1004010, A8832
IUPAC Name
8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
Canonical SMILES
CN1C2CCC1CC(C2)N.Cl.Cl
InChI Key
KVYQKWPZQKGICY-UHFFFAOYSA-N
Boiling Point
181.6ºC at 760 mmHg
Melting Point
250ºC
Flash Point
60.8ºC
Exact Mass
212.08500
Hazard Statements
Xn: Harmful;
H-Bond Acceptor
2
H-Bond Donor
3
Safety Description
S22-S26-S36/37/39
What is the molecular formula of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The molecular formula of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is C8H18Cl2N2.

What is the molecular weight of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The molecular weight of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is 213.15 g/mol.

What is the IUPAC Name of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The IUPAC Name of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride.

What is the InChI of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The InChI of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is InChI=1S/C8H16N2.2ClH/c1-10-7-2-3-8(10)5-6(9)4-7;;/h6-8H,2-5,9H2,1H3;2*1H/t6?,7-,8+;;

What is the Canonical SMILES of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The Canonical SMILES of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is CN1C2CCC1CC(C2)N.Cl.Cl.

What is the hydrogen bond donor count of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The hydrogen bond donor count of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is 3.

What is the hydrogen bond acceptor count of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The hydrogen bond acceptor count of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is 2.

How many rotatable bonds are there in 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

There are 0 rotatable bonds in 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride.

What is the topological polar surface area of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

The topological polar surface area of 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride is 29.3Ų.

How many covalently-bonded units are there in 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride?

There are 3 covalently-bonded units in 8-Methyl-8-aza-bicyclo[3.2.1]octan-3-amine dihydrochloride.

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