(2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoro-2-pyrrolidinecarboxylic Acid - >96.0%(T), high purity , CAS No.203866-14-2

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Item Number

S161408

Grouped product items
SKU	Size	Availability	Price
S161408-250mg	250mg	2	$70.90
S161408-1g	1g	1	$178.90
S161408-5g	5g	1	$803.90
S161408-10g	10g	1	$1,446.90

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Basic Description

Synonyms	(2S,4R)-1-(tert-butoxycarbonyl)-4-fluoropyrro lidine-2-carboxylic acid \| (2S,4R)-1-(tert-butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid \| AC-14450 \| (2S,4R)-1-Boc-4-fluoro-2-pyrrolidinecarboxylic Acid \| AM20090157 \| rel-(2S,4R)-1-(tert-Butoxycarbon
Specifications & Purity	≥96%(T)
Storage Temp	Argon charged
Shipped In	Normal

Names and Identifiers

Pubchem Sid	488197858
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488197858
IUPAC Name	(2S,4R)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
INCHI	InChI=1S/C10H16FNO4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5H2,1-3H3,(H,13,14)/t6-,7+/m1/s1
InChi Key	YGWZXQOYEBWUTH-RQJHMYQMSA-N
Canonical SMILES	CC(C)(C)OC(=O)N1CC(CC1C(=O)O)F
Isomeric SMILES	CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)O)F
WGK Germany	3
PubChem CID	12043048
Molecular Weight	233.24
Reaxy-Rn	7975240

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
L2416208	Certificate of Analysis	Dec 25, 2024	S161408
C2006148	Certificate of Analysis	Dec 20, 2023	S161408

Chemical and Physical Properties

Solubility	Soluble in Methanol
Specific Rotation[α]	-69° (C=1,MeOH)
Melt Point(°C)	116 °C
Molecular Weight	233.240 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	233.106 Da
Monoisotopic Mass	233.106 Da
Topological Polar Surface Area	66.800 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	300.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Reaxy-Rn	7975240

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Basic Description