(1S,3S)-3-(Boc-amino)cyclohexanecarboxylic acid, 98%

Name: (1S,3S)-3-(Boc-amino)cyclohexanecarboxylic acid
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

1008773-73-6

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IUPAC name	(1S,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylic acid
inchi	InChI=1S/C12H21NO4/c1-12(2,3)17-11(16)13-9-6-4-5-8(7-9)10(14)15/h8-9H,4-7H2,1-3H3,(H,13,16)(H,14,15)/t8-,9-/m0/s1
inchi key	JSGHMGKJNZTKGF-IUCAKERBSA-N
molecular formula	C12H21NO4
synonyms	1008773-73-6 (1S,3S)-3-{[(tert-butoxy)carbonyl]amino}cyclohexane-1-carboxylic acid Cyclohexanecarboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, (1S,3S)- (1S,3S)-3-([(tert-Butoxy)carbonyl]amino)cyclohexane-1-carboxylic acid 218772-92-0

Computed Properties

Molecular Weight:	243.30 g/mol
XLogP3:	1.7
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	4
Rotatable Bond Count:	4
Exact Mass:	243.14705815 g/mol
Monoisotopic Mass:	243.14705815 g/mol
Topological Polar Surface Area:	75.6 Å²
Heavy Atom Count:	17
Formal Charge:	0
Complexity:	295
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	2
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. 2A (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: AX4000

(1S,3S)-3-(Boc-amino)cyclohexanecarboxylic acid, 98%

Product No: AX4000

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Product No: AX4000

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?