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(R)-1-Boc-4,4-difluoropyrrolidine-2-carboxylic acid

(R)-1-Boc-4,4-difluoropyrrolidine-2-carboxylic acid - CAS 536747-87-2

Name: (R)-1-Boc-4,4-difluoropyrrolidine-2-carboxylic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB054625
Product Name:	(R)-1-Boc-4,4-difluoropyrrolidine-2-carboxylic acid
CAS:	536747-87-2
Synonyms:	(R)-1-(Tert-butoxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid; (2R)-1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-2-carboxylic acid

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	(2R)-4,4-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Molecular Weight:	251.23
Molecular Formula:	C10H15F2NO4
Canonical SMILES:	CC(C)(C)OC(=O)N1CC(CC1C(=O)O)(F)F
InChI:	InChI=1S/C10H15F2NO4/c1-9(2,3)17-8(16)13-5-10(11,12)4-6(13)7(14)15/h6H,4-5H2,1-3H3,(H,14,15)/t6-/m1/s1
InChI Key:	WTMZYKCXBXPVPT-ZCFIWIBFSA-N
Boiling Point:	340.4±42.0 °C at 760 mmHg
Density:	1.31±0.1 g/cm3
Storage:	Store at 2-8°C

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[87-88-7]C6H2Cl2O4
Chloranilic acid
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[151585-93-2]C7H6FNO
2-Amino-6-fluorobenzaldehyde
[113366-46-4]C7H9NO2S
2-Ethyl-4-methyl-1,3-thiazole-5-carboxylic acid

Fluorinated Building Blocks

[1427357-61-6]C6H4FN3
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[1946823-77-3]C7H9F3N2O
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1106917-71-8]C8H10ClF2NO
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Oxygen Compounds

[134769-80-5]C11H16O2
3-Methylphenylacetaldehyde dimethyl acetal
[52378-69-5]C13H19O3P
Diethyl trans-cinnamylphosphonate
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[2960-93-2]C22H18O2
2,2'-Dimethoxy-1,1'-binaphthalene
[88-60-8]C11H16O
2-tert-Butyl-5-methylphenol

Pyrrolidines

[1220027-22-4]C11H24Cl2N2
4-Methyl-1-(2-Pyrrolidinylmethyl)Piperidine Dihydrochloride
[1228070-72-1]C17H23ClN2O4
(Racemic trans)-1-tert-butyl 3-methyl 4-(2-Chloro-5-methylpyridin-3-yl)pyrrolidine-1,3-dicarboxylate
[75847-73-3]C20H28N2O5
Enalapril
[5747-92-2]C14H19NO2
Ethyl 1-benzyl-pyrrolidine-3-carboxylate
[60298-18-2]C7H11NO3
Ethyl 5-oxopyrrolidine-3-carboxylate
[104253-38-5]C16H17NO6
Monobenzyl glutaryl n-hydroxysuccinimide

GHS Hazard Statement:	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]
Precautionary Statement:	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
Signal Word:	Warning

Complexity:	338
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	251.09691428
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	251.09691428
Rotatable Bond Count:	3
Topological Polar Surface Area:	66.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5