AG006M2H

908142-03-0 | Boronic acid, B-​[3-​(hydroxymethyl)​-​4-​methoxyphenyl]​-

AG006M2H

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CAS Number	908142-03-0
Catalog Number	AG006M2H(AGN-PC-09RRC1)
Chemical Name	Boronic acid, B-​[3-​(hydroxymethyl)​-​4-​methoxyphenyl]​-
IUPAC Name	[3-(hydroxymethyl)-4-methoxyphenyl]boronic acid
InChI	InChI=1S/C8H11BO4/c1-13-8-3-2-7(9(11)12)4-6(8)5-10/h2-4,10-12H,5H2,1H3
InChI Key	DOQUCBSZQOPLGT-UHFFFAOYSA-N
MDL Number	MFCD14155851
Molecular Formula	C8H11BO4
Molecular Weight	181.9815
SMILES	C(O)c1c(OC)ccc(c1)B(O)O
Synonyms	908142-03-0, (3-(hydroxymethyl)-4-Methoxyphenyl)boronic acid, 3-HYDROXYMETHYL-4-METHOXYPHENYLBORONIC ACID, 3-(hydroxymethyl)-4-methoxyphenylboronic acid, [3-(hydroxymethyl)-4-methoxyphenyl]boronic acid, MFCD14155851, AK113018, KSC005Q4B, CTK9A5840, DTXSID90696037, ACT10561, 5123AC, CH-528, AKOS016009858, ZINC169744732, DS-6075, FCH1178018, LS11018, RL05707, VB10628, BC001258, OR360294, SY029351, AX8220264, 3-Hydroxymethyl-4-methoxybenzeneboronic acid, 4CH-001228, ST24034273, MFCD14155851 (95%), 3-(Hydroxymethyl)-4-methoxybenzeneboronic Acid, Z-2617, J-512649, B-[3-(HYDROXYMETHYL)-4-METHOXYPHENYL]-BORONIC ACID, BORONIC ACID, B-[3-(HYDROXYMETHYL)-4-METHOXYPHENYL]-, 3-(Hydroxymethyl)-4-methoxyphenylboronic Acid (contains varying amounts of Anhydride), C8H11BO4, ACN-052637, H1563, (3-(Hydroxymethyl)-4-methoxyphenyl)boronicacid,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.075g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	181.982g/mol
Monoisotopic Mass	182.075g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	69.9A^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-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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