AG001N2I

151075-20-6 | 3-Cyclohexene-1-carboxylic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester

AG001N2I

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CAS Number	151075-20-6
Catalog Number	AG001N2I(AGN-PC-0HAZ6B)
Chemical Name	3-Cyclohexene-1-carboxylic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
IUPAC Name	methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-ene-1-carboxylate
InChI	InChI=1S/C14H23BO4/c1-13(2)14(3,4)19-15(18-13)11-8-6-10(7-9-11)12(16)17-5/h8,10H,6-7,9H2,1-5H3
InChI Key	SXBXVZNWDYRGPR-UHFFFAOYSA-N
MDL Number	MFCD11520532
Molecular Formula	C14H23BO4
Molecular Weight	266.1410
SMILES	CC1(C)C(C)(C)OB(C2=CCC(C(OC)=O)CC2)O1
Synonyms	151075-20-6, Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-enecarboxylate, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-Cyclohexene-1-carboxylic acid methyl ester, 4-(Methoxycarbonyl)cyclohexene-1-boronic acid pinacol ester, methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-ene-1-carboxylate, SXBXVZNWDYRGPR-UHFFFAOYSA-N, SCHEMBL1289681, DTXSID10736146, KS-00000I5Y, 7567AA, MFCD11520532, RW2921, AKOS016011154, CS-W006636, DS-6403, QC-1897, AK121867, SC-48452, SY022065, AB0047822, DB-063878, 4CH-005338, FT-0744237, ST24031064, MFCD11520532 (95%), 4-Carbomethoxy-1-cyclohexeneboronic Acid Pinacol Ester, (4-(METHOXYCARBONYL)CYCLOHEX-1-EN-1-YL)BORONIC ACID PINACOL ESTER, Methyl 4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)cyclohex-3-enecarboxylate, 3-Cyclohexene-1-carboxylic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester, C14H23BO4, ACN-046494, 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3-, 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3- cyclohexene-1-carboxylic acid methyl ester,

Complexity	384
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	266.169g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	266.144g/mol
Monoisotopic Mass	266.169g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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