Name: H-VAL-BETANA
SKU: 729-24-8

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Basic Information

Molecular Structure:
CAS No.:	729-24-8
Name:	H-VAL-BETANA

Formula:	C₁₅H₁₈N₂O
Molecular Weight:	242.32
Synonyms:	Butanamide,2-amino-3-methyl-N-2-naphthalenyl-, (S)-;Butyramide,2-amino-3-methyl-N-2-naphthyl-, L- (8CI);L-Valine b-naphthylamide;L-Valyl b-naphthylamide;Valine b-naphthylamide;Valyl-b-naphthylamide;
Density:	1.15 g/cm³
Boiling Point:	457.9 °C at 760 mmHg
Flash Point:	230.7 °C
Hazard Symbols:	Xn
Risk Codes:	40
Safety:	22-36
PSA:	55.12000
LogP:	3.53490

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Specification

The Butanamide,2-amino-3-methyl-N-2-naphthalenyl-, (2S)-, with the CAS registry number 729-24-8, is also known as L-valine-B-naphthylamide. This chemical's molecular formula is C₁₅H₁₈N₂O and molecular weight is 242.32. What's more, its systematic name is N-naphthalen-2-ylvalinamide. Its storage temperature is -20 °C.

Physical properties of Butanamide,2-amino-3-methyl-N-2-naphthalenyl-, (2S)- are: (1)ACD/LogP: 1.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.26; (4)ACD/LogD (pH 7.4): 1.43; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 5.4; (7)ACD/KOC (pH 5.5): 1.71; (8)ACD/KOC (pH 7.4): 83.02; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 23.55 Å²; (13)Index of Refraction: 1.638; (14)Molar Refractivity: 75.71 cm³; (15)Molar Volume: 210.5 cm³; (16)Polarizability: 30.01×10^-24 cm³; (17)Surface Tension: 49.3 dyne/cm; (18)Density: 1.15 g/cm³; (19)Flash Point: 230.7 °C; (20)Enthalpy of Vaporization: 71.81 kJ/mol; (21)Boiling Point: 457.9 °C at 760 mmHg; (22)Vapour Pressure: 1.44E-08 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
There is limited evidence of a carcinogenic effect. You should not breathe dust. However, you should wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: O=C(Nc2ccc1c(cccc1)c2)C(N)C(C)C
(2)InChI: InChI=1/C15H18N2O/c1-10(2)14(16)15(18)17-13-8-7-11-5-3-4-6-12(11)9-13/h3-10,14H,16H2,1-2H3,(H,17,18)
(3)InChIKey: OBGGZBHESVNMSA-UHFFFAOYAP