Exo-2-bornanamine

HCID 98480

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Basic information

CAS: 31002-73-0
Standard SMILES: NC1CC2CCC1C2
InChIKey: JEPPYVOSGKWVSJ-UHFFFAOYSA-N
Molecular formula: C7H13N
Average molar mass: 111.18 g/mol
Monoisotopic mass: 111.10479942

Names & identifiers

Preferred name: Exo-2-bornanamine
IUPAC: bicyclo[2.2.1]heptan-2-amine
English name: bicyclo[2.2.1]heptan-2-amine
Molecular formula: C7H13N
Molecular weight: 111.18

Names & synonyms

exo-2-BornanamineEINECS 230-647-6RefChem:596984230-647-67242-92-4bicyclo[2.2.1]heptan-2-amine822-98-02-Norbornanamineendo-2-Aminonorbornaneexo-norbornan-2-amineBicyclo[2.2.1]hept-2-ylamineMFCD00167748

Show more names

Norbornylamine2-NorbornylamineNorcamphanylamineNorbornane-2-amineBicyclo[2.2.1]heptan-3-aminebicyclo[2.2.1]hept-2-ylamine(SALTDATA: 0.15H2O 0.15H2CO3)

Exo-2-aminonorborane(1S,2S,4S)-norbornan-2-amine130463-97-7Bicyclo(2.2.1)heptan-2-amine31002-73-0(1S,2R,4S)-norbornan-2-amineBicyclo[2.2.1]heptan-2-amine, exo-endo-norbornan-2-amine

Database identifiers

CAS: 31002-73-0、7242-92-4、822-98-0
PubChem CID: 98480
DTXSID: DTXSID701373099
ChEMBL: CHEMBL3736576
EC Number: 212-510-2、230-647-6
Nikkaji: J81.968I

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 8
Formal charge: 0
Complexity: 101

Physicochemical properties

Melting point: 75 · 75-80 °C
Boiling point: 156 · 156-157 °C
Density: 0.985 · 0.985±0.06 g/cm3(Predicted)
storage temp.: 0 · Store at 0-8 °C
pka: 10.96 · 10.96±0.20(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H332-H335
Precautionary statements: 233 · P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
RIDADR: 2920 · 2920
HazardClass: 8 · 8
PackingGroup: II

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

ridadr: 2920
Signal word: Warning
Symbol(GHS): GHS07
hazard_class: 8
packing_group: II
Hazard statements: H302-H315-H319-H332-H335
Precautionary statements: P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501

Chemistry & industry

Applications

UsesBicyclo[2.2.1]hept-2-amine is an organic intermediate that can be prepared from norbornene or norbornol. Bicyclo[2.2.1]hept-2-amine can be used to prepare norbornane isocyanate.