CAS No.104530-16-7,(+)-Camphanic acid chloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	104530-16-7
Name:	(+)-Camphanic acid chloride
Article Data:	3

Formula:	C₁₀H₁₃ClO₃
Molecular Weight:	216.664
Synonyms:	(+)-Camphanoyl chloride;
EINECS:	254-552-4
Density:	1.298 g/cm³
Melting Point:	67-70 °C
Boiling Point:	299.5 °C at 760 mmHg
Flash Point:	125 °C
Hazard Symbols:	C,Xn
Risk Codes:	34-36/37/38-20/21/22
Safety:	26-36/37/39-45-36
PSA:	43.37000
LogP:	1.87370

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Specification

The (+)-Camphanic acid chloride is an organic compound with the formula C₁₀H₁₃ClO₃. The systematic name of this chemical is (1R,4S)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl chloride. With the CAS registry number 104530-16-7, it is also named as 2-oxabicyclo[2.2.1]heptane-1-carbonyl chloride, 4,7,7-trimethyl-3-oxo-, (1R,4S)-. The product's category is Chiral Compound.

Physical properties about (+)-Camphanic acid chloride are: (1)ACD/LogP: 0.96; (2)ACD/LogD (pH 5.5): 0.96; (3)ACD/LogD (pH 7.4): 0.96; (4)ACD/BCF (pH 5.5): 3.17; (5)ACD/BCF (pH 7.4): 3.17; (6)ACD/KOC (pH 5.5): 79.45; (7)ACD/KOC (pH 7.4): 79.45; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 43.37 Å²; (11)Index of Refraction: 1.52; (12)Molar Refractivity: 50.71 cm³; (13)Molar Volume: 166.8 cm³; (14)Polarizability: 20.1×10^-24cm³; (15)Surface Tension: 44.1 dyne/cm; (16)Density: 1.298 g/cm³; (17)Flash Point: 125 °C; (18)Enthalpy of Vaporization: 53.95 kJ/mol; (19)Boiling Point: 299.5 °C at 760 mmHg; (20)Vapour Pressure: 0.00119 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. It can cause burns. When you are using it, wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Cl)[C@@]12OC(=O)[C@@](CC1)(C2(C)C)C
(2)InChI: InChI=1/C10H13ClO3/c1-8(2)9(3)4-5-10(8,6(11)12)14-7(9)13/h4-5H2,1-3H3/t9-,10+/m1/s1
(3)InChIKey: PAXWODJTHKJQDZ-ZJUUUORDBT
(4)Std. InChI: InChI=1S/C10H13ClO3/c1-8(2)9(3)4-5-10(8,6(11)12)14-7(9)13/h4-5H2,1-3H3/t9-,10+/m1/s1
(5)Std. InChIKey: PAXWODJTHKJQDZ-ZJUUUORDSA-N