Product Name: 2-Octanol,(2R)- (CAS NO.5978-70-1)
Molecular Formula: C8H18O
Molecular Weight: 130.23g/mol
Mol File: 5978-70-1.mol
EINECS: 227-777-0
Melting Point: 177.9 °C at 760 mmHg
Flash Point: 71.1 °C
Density: 0.821 g/cm3
Refractive index: n20/D 1.426(lit.)
Surface Tension: 28 dyne/cm
Enthalpy of Vaporization: 48.22 kJ/mol
Vapour Pressure: 0.306 mmHg at 25°C
XLogP3-AA: 2.9
H-Bond Donor: 1
H-Bond Acceptor: 1
Structure Descriptors of 2-Octanol,(2R)- (CAS NO.5978-70-1):
IUPAC Name: (2R)-octan-2-ol
Canonical SMILES: CCCCCCC(C)O
Isomeric SMILES: CCCCCC[C@@H](C)O
InChI: InChI=1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3/t8-/m1/s1
InChIKey: SJWFXCIHNDVPSH-MRVPVSSYSA-N
Product Categories: Alcohols, Hydroxy Esters and Derivatives; Chiral Compounds; chiral; Building Blocks for Liquid Crystals; Chiral Building Blocks; Chiral Compounds (Building Blocks for Liquid Crystals); Functional Materials; Simple Alcohols (Chiral); Synthetic Organic Chemistry
Safety Information of 2-Octanol,(2R)- (CAS NO.5978-70-1):
Hazard Codes: Xi
Risk Statements: 36/37/38
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements: 26-36
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
WGK Germany: 3
HS Code: 29051620
2-Octanol,(2R)- , its CAS NO. is 5978-70-1, the synonyms are EINECS 227-777-0 ; 2-Octanol, (theta)- ; l-Octan-2-ol .
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