AG003JDU

4334-87-6 | 3-Ethoxycarbonylphenylboronic acid

AG003JDU

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CAS Number	4334-87-6
Catalog Number	AG003JDU(AGN-PC-0KR5Y6)
Chemical Name	3-Ethoxycarbonylphenylboronic acid
IUPAC Name	(3-ethoxycarbonylphenyl)boronic acid
InChI	InChI=1S/C9H11BO4/c1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-6,12-13H,2H2,1H3
InChI Key	REHVCPNQQBDOJJ-UHFFFAOYSA-N
MDL Number	MFCD02179444
Molecular Formula	C9H11BO4
Molecular Weight	193.9922
SMILES	CCOC(C1=CC(=CC=C1)B(O)O)=O
Synonyms	3-Ethoxycarbonylphenylboronic acid, 4334-87-6, 3-(Ethoxycarbonyl)phenylboronic acid, (3-ethoxycarbonylphenyl)boronic Acid, 3-carbethoxyphenylboronic acid, (3-(ethoxycarbonyl)phenyl)boronic acid, m-ethoxycarbonylphenylboronic acid, MFCD02179444, 3-Ethoxycarbonylbenzeneboronic acid, Ethyl 3-(Dihydroxyboranyl)Benzoate, [3-(ethoxycarbonyl)phenyl]boronic acid, 3-(ethoxycarbonyl)benzeneboronic acid, 3-(ethoxycarbonyl)phenyl boronic acid, Akos Brn-0097, BENZOIC ACID, 3-BORONO-, 1-ETHYL ESTER, PubChem6092, Phenylboronic Acid, 2, ACMC-1AETQ, AC1MN4AE, AC1Q33WF, KSC489M0T, SCHEMBL361141, 3-carboethoxybenzeneboronic acid, CHEMBL488800, 3-(carbethoxy)phenylboronic acid, 3-carbethoxy-phenyl-boronic acid, BDBM26123, CTK3I9609, DTXSID20390632, REHVCPNQQBDOJJ-UHFFFAOYSA-N, 3-ethoxycarbonyl-phenylboronic acid, 3-ethoxycarbonylphenyl boronic acid, ACT11007, KS-000001RP, 3-(Ethoxycarbonyl)phenylboranic acid, 3-ethoxycarbonyl phenyl boronic acid, ANW-29972, CE-175, SBB052545, (3-ethoxycarbonylphenyl) boronic acid, 3-(ethoxycarbonyl) phenylboronic acid, 3-(ethoxycarbonyl)-phenylboronic acid, 3-(ethoxycarbonyl)phenyl-boronic acid, 3-CARBOETHOXYPHENYLBORONIC ACID, AKOS004116253, ZINC169743250, AB11142, AC-6988, AN-9476, AS-3169, CS-W015758, LS10834, RP03938, RTR-016831, TRA0036062, VB10256, NCGC00249523-01, AK-44361, BR-44361, N080, SY014657, AB0015540, AB1004662, DB-010492, ST2410664, TL8003050, TR-016831, {3-[(ethyloxy)-carbonyl]phenyl}boronic acid, 4CH-012998, AM20050278, E0848, FT-0084878, FT-0615112, B-2323, 34700-EP2301536A1, 34700-EP2301538A1, 34700-EP2311455A1, MFCD02179444 (97+%), 334E876, I01-0963, J-510876, 3-(Ethoxycarbonyl)benzeneboronic acid; Ethyl 3-boronobenzoate, Ethyl 3-boronobenzoate, D05FZP, 2-methoxypyridine-3,4-diamine, C9H11BO4, 3-Ethoxycarbonylphenylboronicacid, ACN-029136, CID3249312, 3-Ethoxycarbonylphenylboronic acid, 98% - 1g 1g, 32289-58-0,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.075g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	193.993g/mol
Monoisotopic Mass	194.075g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
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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