7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine supplier

Name
7-benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine
EINECS
CAS No. 859825-79-9
Article Data7
CAS DataBase
Density 1.331 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₅ClN₄
Boiling Point 478.8 °C at 760 mmHg
Molecular Weight 274.753
Flash Point 243.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine;
PSA 55.04000
LogP 2.78960

7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine Specification

The cas register number of 7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine is 859825-79-9. The Systematic name about this chemical is 7-benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine. It belongs to the Chiral chemicals.

Physical properties about 7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine are: (1)ACD/LogP: 1.86; (2)ACD/LogD (pH 5.5): 1.81; (3)ACD/LogD (pH 7.4): 1.86; (4)ACD/BCF (pH 5.5): 13.43; (5)ACD/BCF (pH 7.4): 15.31; (6)ACD/KOC (pH 5.5): 215.11; (7)ACD/KOC (pH 7.4): 245.28; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 55.04Å²; (12)Index of Refraction: 1.663; (13)Molar Refractivity: 76.47 cm³; (14)Molar Volume: 206.3 cm³; (15)Polarizability: 30.31x10^-24cm³; (16)Surface Tension: 66.4 dyne/cm; (17)Enthalpy of Vaporization: 74.29 kJ/mol; (18)Boiling Point: 478.8 °C at 760 mmHg; (19)Vapour Pressure: 2.5E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc2nc1CN(CCc1c(Cl)n2)Cc3ccccc3
(2)InChI: InChI=1/C14H15ClN4/c15-13-11-6-7-19(8-10-4-2-1-3-5-10)9-12(11)17-14(16)18-13/h1-5H,6-9H2,(H2,16,17,18)
(3)InChIKey: SARXNIGUYDNRMJ-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C14H15ClN4/c15-13-11-6-7-19(8-10-4-2-1-3-5-10)9-12(11)17-14(16)18-13/h1-5H,6-9H2,(H2,16,17,18)
(5)Std. InChIKey: SARXNIGUYDNRMJ-UHFFFAOYSA-N

Product Name

7-benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine

7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine Specification

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