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Cyclopropanamine,1-(4-bromophenyl)-

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Name

Cyclopropanamine,1-(4-bromophenyl)-

EINECS N/A
CAS No. 345965-54-0 Density 1.519 g/cm3
PSA 26.02000 LogP 3.09720
Solubility N/A Melting Point N/A
Formula C9H10BrN Boiling Point 261.9 °C at 760 mmHg
Molecular Weight 212.089 Flash Point 112.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 345965-54-0 (1-(4-BROMO-PHENYL)-CYCLOPROPYLAMINE) Hazard Symbols N/A
Synonyms

1-(4-Bromophenyl)cyclopropylamine;

Article Data 15

Cyclopropanamine,1-(4-bromophenyl)- Specification

The CAS registry number of Cyclopropanamine,1-(4-bromophenyl)- is 345965-54-0. This chemical's molecular formula is C9H10BrN and molecular weight is 212.0864. What's more, its systematic name is 1-(4-Bromophenyl)cyclopropylamine.

Physical properties about Cyclopropanamine,1-(4-bromophenyl)- are: (1)ACD/LogP: 2.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 1.24; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 3.15; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 44; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 26.02 Å2; (12)Index of Refraction: 1.626; (13)Molar Refractivity: 49.42 cm3; (14)Molar Volume: 139.6 cm3; (15)Polarizability: 19.59×10-24 cm3; (16)Surface Tension: 53.8 dyne/cm; (17)Density: 1.519 g/cm3; (18)Flash Point: 112.2 °C; (19)Enthalpy of Vaporization: 49.97 kJ/mol; (20)Boiling Point: 261.9 °C at 760 mmHg; (21)Vapour Pressure: 0.0112 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: NC1(CC1)c2ccc(Br)cc2
(2) InChI: InChI=1/C9H10BrN/c10-8-3-1-7(2-4-8)9(11)5-6-9/h1-4H,5-6,11H2
(3) InChIKey: PGTDLVUAYUMZNU-UHFFFAOYAS

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