1-Boc-indole, 98%

Name: 1-Boc-indole
Brand: Chempure

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CAS Number

75400-67-8

Molecular Weight

217.26

Formula

C13H15NO2

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About this item

IUPAC name	tert-butyl indole-1-carboxylate
inchi	InChI=1S/C13H15NO2/c1-13(2,3)16-12(15)14-9-8-10-6-4-5-7-11(10)14/h4-9H,1-3H3
inchi key	OWPIFQXNMLDXKW-UHFFFAOYSA-N
molecular formula	C13H15NO2
synonyms	1-Boc-indole 75400-67-8 tert-butyl 1H-indole-1-carboxylate tert-butyl indole-1-carboxylate tert-Butyl 1-indolecarboxylate

Computed Properties

Molecular Weight:	217.26 g/mol
XLogP3:	3.3
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	2
Exact Mass:	217.110278721 g/mol
Monoisotopic Mass:	217.110278721 g/mol
Topological Polar Surface Area:	31.2 Å²
Heavy Atom Count:	16
Formal Charge:	0
Complexity:	270
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2 (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: AR0783

1-Boc-indole, 98%

Product No: AR0783

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Product No: AR0783

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?