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10171-76-3

Basic Information
CAS No.: 10171-76-3
Name: (1R,4S)-N-[[(1S,4R)-Bicyclo[2.2.1]heptan-2α-yl]methyl]bicyclo[2.2.1]heptane-2β-methanamine
Article Data: 3
Molecular Structure:
Molecular Structure of 10171-76-3 ((1R,4S)-N-[[(1S,4R)-Bicyclo[2.2.1]heptan-2α-yl]methyl]bicyclo[2.2.1]heptane-2β-methanamine)
Formula: C16H27 N
Molecular Weight: 233.397
Synonyms: Dimethylamine,1,1'-di-2-norbornyl-, endo,endo- (8CI); Bis(2,5-endomethylenecyclohexylmethyl)amine
Density: 1.002g/cm3
Boiling Point: 307.4°C at 760 mmHg
Flash Point: 134.9°C
Safety: Poison by skin contact. Moderately toxic by ingestion. A skin irritant. When heated to decomposition it emits toxic fumes of NOx.
PSA: 12.03000
LogP: 3.83930
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  • Bis(2,5-endomethylenecyclohexylmethyl)amine

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  • Bicyclo[2.2.1]heptane-2-methanamine,N-(bicyclo[2.2.1]hept-2-ylmethyl)-, (endo,endo)- (9CI)

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    10171-76-3

    Bicyclo[2.2.1]heptane-2-methanamine,N-(bicyclo[2.2.1]hept-2-ylmethyl)-, (endo,endo)- (9CI)

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  • (1R,4S)-N-[[(1S,4R)-Bicyclo[2.2.1]heptan-2α-yl]methyl]bicyclo[2.2.1]heptane-2β-methanamine

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    10171-76-3

    (1R,4S)-N-[[(1S,4R)-Bicyclo[2.2.1]heptan-2α-yl]methyl]bicyclo[2.2.1]heptane-2β-methanamine

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Chemistry

Product Name: Bis(2,5-endomethylenecyclohexylmethyl)amine (CAS NO.10171-76-3)


Molecular Formula: C16H27N
Molecular Weight: 233.44g/mol
Mol File: 10171-76-3.mol
Boiling point: 307.4 °C at 760 mmHg
Density: 1.002 g/cm3 
Surface Tension: 39.1 dyne/cm
Enthalpy of Vaporization: 54.8 kJ/mol
Vapour Pressure: 0.000728 mmHg at 25°C
XLogP3-AA: 4.4
H-Bond Donor: 1
H-Bond Acceptor: 1
IUPAC Name: 1-(6-bicyclo[2.2.1]heptanyl)-N-(6-bicyclo[2.2.1]heptanylmethyl)
methanamine
Canonical SMILES: C1CC2CC1CC2CNCC3CC4CCC3C4
InChI: InChI=1S/C16H27N/c1-3-13-5-11(1)7-15(13)9-17-10-16-8-12-2-4-14(16)6-12/
h11-17H,1-10H2 
InChIKey: CEKRYRXNZFBGPG-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

skn-rbt 100 µg/24H open

    AIHAAP    American Industrial Hygiene Association Journal. 23 (1962),95.
2.    

orl-rat LD50:1410 mg/kg

    AIHAAP    American Industrial Hygiene Association Journal. 23 (1962),95.
3.    

skn-rbt LD50:110 mg/kg

    AIHAAP    American Industrial Hygiene Association Journal. 23 (1962),95.

Safety Profile

Poison by skin contact. Moderately toxic by ingestion. A skin irritant. When heated to decomposition it emits toxic fumes of NOx.

Specification

 Bis(2,5-endomethylenecyclohexylmethyl)amine ,its CAS NO. is 10171-76-3,the synonyms is Dimethylamine, 1,1'-di-2-norbornyl-, endo,endo- ; CID25029 ; NSC47607 ; LS-62029 .