AG007PNT

216485-86-8 | 3-Isopropoxyphenylboronic acid

AG007PNT

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CAS Number	216485-86-8
Catalog Number	AG007PNT(AGN-PC-07HAGK)
Chemical Name	3-Isopropoxyphenylboronic acid
IUPAC Name	(3-propan-2-yloxyphenyl)boronic acid
InChI	InChI=1S/C9H13BO3/c1-7(2)13-9-5-3-4-8(6-9)10(11)12/h3-7,11-12H,1-2H3
InChI Key	UKZVUHVNTYDSOP-UHFFFAOYSA-N
MDL Number	MFCD03701512
Molecular Formula	C9H13BO3
Molecular Weight	180.0087
SMILES	C(C)(C)OC1=CC=CC(=C1)B(O)O
Synonyms	3-Isopropoxyphenylboronic acid, 216485-86-8, (3-Isopropoxyphenyl)boronic acid, 3-ISOPROPOXYBENZENEBORONIC ACID, 3-Isopropoxyphebylboronic acid, (3-propan-2-yloxyphenyl)boronic Acid, MFCD03701512, [3-(propan-2-yloxy)phenyl]boronic acid, 3-(1-METHYLETHOXY)PHENYLBORONIC ACID, 3-(1-METHYLETHYL)OXYPHENYLBORONIC ACID, 3-iso-Propoxyphenylboronic acid, ACMC-1CKJX, SCHEMBL7998, 5-isopropoxyphenylboronic acid, 3-Isopropoxyphenbylboronic acid, AC1NO873, CTK4E7413, DTXSID90408157, UKZVUHVNTYDSOP-UHFFFAOYSA-N, KS-00000MM2, ANW-24541, CI-164, FC0731, SBB071251, AKOS004113740, ZINC169745639, AB15772, CS-W008010, LS10853, QC-4550, RL02655, RTR-036158, TRA0086003, 3-[(Prop-2-yl)oxy]benzeneboronic acid, NCGC00249552-01, AK-45524, AN-29671, BC001174, BR-45524, DS-13613, N897, SC-86135, AB0016122, AB1004670, DB-010603, ST2417756, AM20060548, FT-0643991, I0984, Boronic acid,B-[3-(1-methylethoxy)phenyl]-, B-7903, A815577, I04-0756, J-512722, 3-Isopropoxyphenylboronic Acid (contains varying amounts of Anhydride), null, C9H13BO3, 3-ISOPROPOXYPHENYLBORONICACID, ACN-032732, CID5083932, 3-Isopropoxyphenylboronic acid, 97% - 1G 1g,

Complexity	150
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.096g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	180.01g/mol
Monoisotopic Mass	180.096g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number