N-Boc-indoline-7-carboxylic acid supplier

Name
N-Boc-indoline-7-carboxylic acid
EINECS
CAS No. 143262-20-8
Article Data5
CAS DataBase
Density 1.257 g/cm³
Solubility
Melting Point 182 °C (dec.)
Formula C₁₄H₁₇NO₄
Boiling Point 401.2 °C at 760 mmHg
Molecular Weight 263.29
Flash Point 196.4 °C
Transport Information UN 3077 9/PG 3
Appearance
Safety 36/37-61
Risk Codes 43-50
Molecular Structure
Hazard Symbols Xi,N
Synonyms 1-(Tert-butoxycarbonyl)indoline-7-carboxylic acid;2,3-Dihydroindole-1,7-dicarboxylic acid 1-tert-butyl ester;1-(tert-Butoxycarbonyl)-2,3-dihydro-1H-indole-7-carboxylic acid;1H-Indole-1,7-dicarboxylicacid, 2,3-dihydro-, 1-(1,1-dimethylethyl) ester;
PSA 66.84000
LogP 2.74740

N-Boc-indoline-7-carboxylic acid Specification

The 1H-Indole-1,7-dicarboxylicacid, 2,3-dihydro-, 1-(1,1-dimethylethyl) ester with CAS registry number of 143262-20-8 is also known as N-Boc-indoline-7-carboxylic acid. The systematic name is 1-(tert-Butoxycarbonyl)-2,3-dihydro-1H-indole-7-carboxylic acid. In addition, the formula is C₁₄H₁₇NO₄ and the molecular weight is 263.29.

Physical properties about 1H-Indole-1,7-dicarboxylicacid, 2,3-dihydro-, 1-(1,1-dimethylethyl) ester are: (1)ACD/LogP: 3.24; (2)ACD/LogD (pH 5.5): 1.58; (3)ACD/LogD (pH 7.4): 0.23; (4)ACD/BCF (pH 5.5): 3.77; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 30.47; (7)ACD/KOC (pH 7.4): 1.36; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.574; (12)Molar Refractivity: 69.12 cm³; (13)Molar Volume: 209.2 cm³; (14)Surface Tension: 51.7 dyne/cm; (15)Density: 1.257 g/cm³; (16)Flash Point: 196.4 °C; (17)Enthalpy of Vaporization: 68.77 kJ/mol; (18)Boiling Point: 401.2 °C at 760 mmHg; (19)Vapour Pressure: 3.72E-07 mmHg at 25 °C.

When you are using this chemical, please be cautious about it. As a chemical, it is very toxic to aquatic organisms and may cause sensitisation by skin contact. During using it, wear suitable protective clothing and gloves. Avoid release to the environment and refer to special instructions/safety data sheet.

You can still convert the following datas into molecular structure:
1. SMILES: OC(=O)c1cccc2CCN(c12)C(=O)OC(C)(C)C
2. InChI: InChI=1/C14H17NO4/c1-14(2,3)19-13(18)15-8-7-9-5-4-6-10(11(9)15)12(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)
3. InChIKey: SUAMIYWLXFROHE-UHFFFAOYAS
4. Std. InChI: InChI=1S/C14H17NO4/c1-14(2,3)19-13(18)15-8-7-9-5-4-6-10(11(9)15)12(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)
5. Std. InChIKey: SUAMIYWLXFROHE-UHFFFAOYSA-N

Product Name

N-Boc-indoline-7-carboxylic acid

N-Boc-indoline-7-carboxylic acid Specification

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