CAS No.5057-98-7,CIS-1,2-CYCLOPENTANEDIOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5057-98-7
Name:	CIS-1,2-CYCLOPENTANEDIOL
Article Data:	9

Formula:	C₅H₁₀O₂
Molecular Weight:	102.133
Synonyms:	1,2-Cyclopentanediol,cis- (8CI);1,2-cis-Cyclopentanediol;cis-1,2-Cyclopentanediol;cis-1,2-Dihydroxycyclopentane;meso-1,2-Cyclopentanediol;
Density:	1.235g/cm³
Melting Point:	24-28 °C(lit.)
Boiling Point:	216.4 °C at 760 mmHg
Flash Point:	112.8 °C
Appearance:	colourless liquid or white solid
Safety:	24/25
PSA:	40.46000
LogP:	-0.10790

Total:11 Page 1 of 1 1

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Specification

The cis-1,2-Cyclopentanediol with the CAS number 5057-98-7 is also called 1,2-Cyclopentanediol,(1R,2S)-rel-. The IUPAC name is (1S,2R)-cyclopentane-1,2-diol. Its molecular formula is C₅H₁₀O₂. This chemical belongs to the following product categories: (1)Alcohols; (2)Monomers; (3)Polymer Science; (4)Organic Building Blocks; (5)Oxygen Compounds; (6)Polyols. While using this chemical, you should avoid this chemical contact with skin and eyes.

The properties of the cis-1,2-Cyclopentanediol are: (1)ACD/LogP: -0.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.41; (4)ACD/LogD (pH 7.4): -0.41; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 14.25; (8)ACD/KOC (pH 7.4): 14.25; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 18.46Å²; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 26.23 cm³; (15)Molar Volume: 82.6 cm³; (16)Polarizability: 10.4×10^-24cm³; (17)Surface Tension: 44.5 dyne/cm; (18)Enthalpy of Vaporization: 52.65 kJ/mol; (19)Vapour Pressure: 0.0304 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O[C@H]1CCC[C@H]1O
(2)InChI: InChI=1/C5H10O2/c6-4-2-1-3-5(4)7/h4-7H,1-3H2/t4-,5+
(3)InChIKey: VCVOSERVUCJNPR-SYDPRGILBS