Benzaldehyde,4-(1-methylethyl)-, oxime supplier

Name
4-(isopropyl)benzaldehyde oxime
EINECS 236-448-0
CAS No. 13372-80-0
Article Data26
CAS DataBase
Density 0.98g/cm³
Solubility
Melting Point 76 °C
Formula C₁₀H₁₃NO
Boiling Point 238.7 °C at 760 mmHg
Molecular Weight 163.219
Flash Point 133.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzaldehyde,p-isopropyl-, oxime (7CI,8CI);4-Isopropylbenzaldehyde oxime;4-Isopropylbenzaldoxime;Cuminaldoxime;NSC 69956;
PSA 32.59000
LogP 2.61810

Benzaldehyde,4-(1-methylethyl)-, oxime Specification

The Benzaldehyde,4-(1-methylethyl)-, oxime, with CAS registry number 13372-80-0, belongs to the following product category: Isopropyl. It has the systematic name of 4-(1-methylethyl)benzaldehyde oxime. And the chemical formula of this chemical is C₁₀H₁₃NO. What's more, its EINECS is 236-448-0.

Physical properties of Benzaldehyde,4-(1-methylethyl)-, oxime: (1)ACD/LogP: 3.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.25; (4)ACD/LogD (pH 7.4): 3.25; (5)ACD/BCF (pH 5.5): 173.41; (6)ACD/BCF (pH 7.4): 173.39; (7)ACD/KOC (pH 5.5): 1394.24; (8)ACD/KOC (pH 7.4): 1394.1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 21.59 Å²; (13)Index of Refraction: 1.512; (14)Molar Refractivity: 49.61 cm³; (15)Molar Volume: 165.1 cm³; (16)Polarizability: 19.66×10^-24cm³; (17)Surface Tension: 33 dyne/cm; (18)Density: 0.98 g/cm³; (19)Flash Point: 133.2 °C; (20)Enthalpy of Vaporization: 50.25 kJ/mol; (21)Boiling Point: 238.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0228 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O\N=C\c1ccc(cc1)C(C)C
(2)InChI: InChI=1/C10H13NO/c1-8(2)10-5-3-9(4-6-10)7-11-12/h3-8,12H,1-2H3/b11-7+
(3)InChIKey: NVKXBDITZDURNJ-YRNVUSSQBI
(4)Std. InChI: InChI=1S/C10H13NO/c1-8(2)10-5-3-9(4-6-10)7-11-12/h3-8,12H,1-2H3/b11-7+
(5)Std. InChIKey: NVKXBDITZDURNJ-YRNVUSSQSA-N

Product Name

4-(isopropyl)benzaldehyde oxime

Benzaldehyde,4-(1-methylethyl)-, oxime Specification

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