2-Azetidinecarboxylicacid, 1-(diphenylmethyl)- supplier

Name
1-Benzhydrylazetidine-2-carboxylic Acid
EINECS
CAS No. 65219-11-6
Article Data2
CAS DataBase
Density 1.235 g/cm³
Solubility
Melting Point
Formula C₁₇H₁₇NO₂
Boiling Point 410.176 °C at 760 mmHg
Molecular Weight 267.327
Flash Point 201.867 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Benzhydrylazetidine-2-carboxylicacid;1-(Diphenylmethyl)azetidine-2-carboxylic acid;
PSA 40.54000
LogP 2.87280

2-Azetidinecarboxylicacid, 1-(diphenylmethyl)- Specification

The 2-Azetidinecarboxylicacid, 1-(diphenylmethyl)-, with the CAS registry number 65219-11-6, is also known as 1-Benzhydrylazetidine-2-carboxylicacid. This chemical's molecular formula is C₁₇H₁₇NO₂ and molecular weight is 267.32. What's more, its systematic name is 1-(diphenylmethyl)azetidine-2-carboxylic acid.

Physical properties of 2-Azetidinecarboxylicacid, 1-(diphenylmethyl)- are: (1)ACD/LogP: 3.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2; (8)ACD/KOC (pH 7.4): 2; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 40.54 Å²; (13)Index of Refraction: 1.631; (14)Molar Refractivity: 77.076 cm³; (15)Molar Volume: 216.43 cm³; (16)Polarizability: 30.555×10^-24cm³; (17)Surface Tension: 56.258 dyne/cm; (18)Density: 1.235 g/cm³; (19)Flash Point: 201.867 °C; (20)Enthalpy of Vaporization: 69.851 kJ/mol; (21)Boiling Point: 410.176 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C3N(C(c1ccccc1)c2ccccc2)CC3
(2)InChI: InChI=1S/C17H17NO2/c19-17(20)15-11-12-18(15)16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,19,20)
(3)InChIKey: UKLYVGBEYKTNBH-UHFFFAOYSA-N

Product Name

1-Benzhydrylazetidine-2-carboxylic Acid

2-Azetidinecarboxylicacid, 1-(diphenylmethyl)- Specification

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