2-Norbornanol

HCID 79028

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Basic information

CAS: 1632-68-4
Standard SMILES: OC1CC2CCC1C2
InChIKey: ZQTYQMYDIHMKQB-UHFFFAOYSA-N
Molecular formula: C7H12O
Average molar mass: 112.17 g/mol
Monoisotopic mass: 112.088815

Names & identifiers

Preferred name: 2-Norbornanol
IUPAC: bicyclo[2.2.1]heptan-2-ol
English name: Bicyclo[2.2.1]heptan-2-ol
Molecular formula: C7H12O
Molecular weight: 112.17

Names & synonyms

Bicyclo[2.2.1]heptan-2-ol1632-68-42-NorbornanolNorborneolNorbornyl alcoholBicyclo(2.2.1)heptan-2-olEINECS 216-637-4NSC 22454DTXSID001030874RefChem:477269DTXCID50209127216-637-4

Show more names

2-NorborneolN-NorborneolNorbornan-2-olALPHA-NORBORNEOLicyclo[2.2.1]heptan-2-olbicyclo[2.2.1]heptan-3-ol

MFCD00167747endo-2-Norbornanolendo-Norbornanolendo-2-Norborneol.alpha.-Norborneol2-endo-Norbornanolexo-Norbornyl alcoholendo-Norborneol

Database identifiers

CAS: 1632-68-4、497-36-9、497-37-0、61277-90-5
PubChem CID: 79028
DTXSID: DTXSID001030874
ChEMBL: CHEMBL1907997
EC Number: 207-844-0、216-637-4、612-111-7
Nikkaji: J13.036B

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 8
Formal charge: 0
Complexity: 101

Experimental & physicochemical properties

SpringerMaterials PropertiesElectric dipole moment

Physicochemical properties

Melting point: 149 °C · 149 °C
Boiling point: 176 · 176-177℃ (760 Torr)
Density: 1.097 · 1.097±0.06 g/cm3 (20 ºC 760 Torr)
Flash point: 74.4 · 74.4±10.9℃
storage temp.: Store at room temperature
pka: 15.31 · 15.31±0.20(Predicted)
form: crystals
color: Colourless
Henry's Law Constant: 2.2 · 2.2×100 mol/(m3Pa) at 25℃, Roon et al. (2005)
EWG's Food Scores: 1 · 1
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 280 · P280-P305+P351+P338-P321
Safety Statements: 23 · 23-24/25
WGK Germany: 3 · 3
RTECS: 7520000 · RB7520000
HS Code: 2906190090 · 2906190090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.