AG00HDZL

1175273-55-8 | tert-butyl (3S)-3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]pyrrolidine-1-carboxylate

AG00HDZL

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CAS Number	1175273-55-8
Catalog Number	AG00HDZL(AGN-PC-0WCX9H)
Chemical Name	tert-butyl (3S)-3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]pyrrolidine-1-carboxylate
IUPAC Name	tert-butyl (3S)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]pyrrolidine-1-carboxylate
InChI	InChI=1S/C18H30BN3O4/c1-16(2,3)24-15(23)21-9-8-14(12-21)22-11-13(10-20-22)19-25-17(4,5)18(6,7)26-19/h10-11,14H,8-9,12H2,1-7H3/t14-/m0/s1
InChI Key	IGWFVUAHNXWIFY-AWEZNQCLSA-N
MDL Number	MFCD28501275
Molecular Formula	C18H30BN3O4
Molecular Weight	363.2595
SMILES	O=C(N1C[C@@H](N2N=CC(B3OC(C)(C)C(C)(C)O3)=C2)CC1)OC(C)(C)C
Synonyms	1175273-55-8, (S)-tert-Butyl 3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)pyrrolidine-1-carboxylate, tert-butyl (3S)-3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]pyrrolidine-1-carboxylate, (S)-(1-(1-(tert-Butoxycarbonyl)pyrrolidin-3-yl)-1H-pyrazol-4-yl)boronic acid pinacol ester, SCHEMBL2422527, IGWFVUAHNXWIFY-AWEZNQCLSA-N, KS-000004MU, MFCD28501275, ZINC201188592, SB12222, AK171058, AS-52284, CS-0048548, (S)-1-(1-Boc-pyrrolidin-3-yl)-1H-pyrazole-4-boronic acid pinacol ester, (S)-3-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyrazol-1-yl]-pyrrolidine-1-carboxylic acid tert-butyl ester, (S)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-pyrazol-1-yl]-pyrrolidincarboxylic Acid tert-butyl Ester, (S)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]pyrrolidine-1-carboxylic acid tert-butyl ester, tert-butyl (3S)-3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]pyrrolidine-1-carboxylate, 1175273-52-5, 1359974-18-7, tert-butyl (3R)-3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]pyrrolidine-1-carboxylate, tert-butyl 3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]pyrrolidine-1-carboxylate,

Complexity	533
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	363.233g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	363.265g/mol
Monoisotopic Mass	363.233g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	65.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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