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1-BOC-INDOLINE

1-BOC-INDOLINE structure

CAS No:
143262-10-6
Formula:
C13H17NO2
Chemical Name:
1-BOC-INDOLINE
Synonyms:
BUTTPARK 52\06-71;1-BOC-INDOLINE;TERT-BUTYL INDOLINE-1-CARBOXYLATE;1-(tert-Butoxycarbonyl)indoline;1H-Indole-1-carboxylic acid, 2,3-dihydro-, 1,1-diMethylethyl ester;N-(tert-Butoxycarbonyl)-2,3-dihydroindole

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1-BOC-INDOLINE Basic Attributes

Molecular Weight：

219.28

Exact Mass：

219.12600

BRN：

5336249

DSSTox ID：

DTXSID30394808

HScode：

2933990090

Characteristics

PSA：

29.5

XLogP3：

3.04920

Density：

1.114g/cm3

Melting Point：

46-50 °C(lit.)

Boiling Point：

83-84 °C0.1 mm Hg(lit.)

Flash Point：

>230 °F

Refractive Index：

1.544

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-BOC-INDOLINE Use and Manufacturing

Reactant in preparation of aryl alkyl amines via alkylation reactions catalyzed by Pd 1 Reactant in preparation of allyl- and arylindolines 2 Reactant in modular indole synthesis of the highly strained CDEF parent tetracycle of nodulisporic acids A and B 3 Reactant in asymmetric synthesis of β-amino esters via rhodium prolinate complex-catalyzed α-C-H activation / carbenoid insertion reactions 4 Reactant in preparation of substituted indolines and tetrahydroquinolines via cycloaddition approach.

Computed Properties

Molecular Weight:219.28
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:219.125928785
Monoisotopic Mass:219.125928785
Topological Polar Surface Area:29.5
Heavy Atom Count:16
Complexity:270
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-BOC-INDOLINE

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

1-BOC-INDOLINE

SDS

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