CAS No.162955-48-8,(S)-(-)-N-Boc-2-Amino-1,5-pentanediol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	162955-48-8
Name:	(S)-(-)-N-Boc-2-Amino-1,5-pentanediol
Article Data:	17

Formula:	C₁₀H₂₁NO₄
Molecular Weight:	219.281
Synonyms:	Carbamicacid, [4-hydroxy-1-(hydroxymethyl)butyl]-, 1,1-dimethylethyl ester, (S)-;
Density:	1.089 g/cm³
Melting Point:	59-62 °C(lit.)
Boiling Point:	399 °C at 760 mmHg
Flash Point:	195.1 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	78.79000
LogP:	1.03540

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Specification

The Carbamic acid,[(1S)-4-hydroxy-1-(hydroxymethyl)butyl]-, 1,1-dimethylethyl ester (9CI) is an organic compound with the formula C₁₀H₂₁NO₄. The IUPAC name of this chemical is Tert-butyl N-[(2S)-1,5-dihydroxypentan-2-yl]carbamate. With the CAS registry number 162955-48-8, it is also named as (S)-(-)-2-(N-Boc-amino)-1,5-pentanediol. The product's categories are N-BOC; Amino alcohols; Chiral building blocks; Organic building blocks. Besides, it should be stored in a sealed, lightproof place.

Physical properties about Carbamic acid,[(1S)-4-hydroxy-1-(hydroxymethyl)butyl]-, 1,1-dimethylethyl ester (9CI) are: (1)ACD/LogP: 0.20; (2)ACD/LogD (pH 5.5): 0.2; (3)ACD/LogD (pH 7.4): 0.2; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 30.42; (7)ACD/KOC (pH 7.4): 30.42; (8)#H bond acceptors: 5; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 48 Å²; (12)Index of Refraction: 1.475; (13)Molar Refractivity: 56.74 cm³; (14)Molar Volume: 201.3 cm³; (15)Polarizability: 22.49×10^-24 cm³; (16)Surface Tension: 40.7 dyne/cm; (17)Density: 1.089 g/cm³; (18)Flash Point: 195.1 °C; (19)Enthalpy of Vaporization: 75.1 kJ/mol; (20)Boiling Point: 399 °C at 760 mmHg; (21)Vapour Pressure: 5.02E-08 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H21NO4/c1-10(2,3)15-9(14)11-8(7-13)5-4-6-12/h8,12-13H,4-7H2,1-3H3,(H,11,14)/t8-/m0/s1
(2)InChIKey: UBNNKNSFDFANKW-QMMMGPOBBK
(3)Std. InChI: InChI=1S/C10H21NO4/c1-10(2,3)15-9(14)11-8(7-13)5-4-6-12/h8,12-13H,4-7H2,1-3H3,(H,11,14)/t8-/m0/s1
(4)Std. InChIKey: UBNNKNSFDFANKW-QMMMGPOBSA-N