AG003HH4

833486-92-3 | 2-Isobutoxyphenylboronic acid

AG003HH4

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CAS Number	833486-92-3
Catalog Number	AG003HH4(AGN-PC-00UQNP)
Chemical Name	2-Isobutoxyphenylboronic acid
IUPAC Name	[2-(2-methylpropoxy)phenyl]boronic acid
InChI	InChI=1S/C10H15BO3/c1-8(2)7-14-10-6-4-3-5-9(10)11(12)13/h3-6,8,12-13H,7H2,1-2H3
InChI Key	WROPRHAJDSQMRO-UHFFFAOYSA-N
MDL Number	MFCD06411371
Molecular Formula	C10H15BO3
Molecular Weight	194.0353
SMILES	CC(C)COC1=C(C=CC=C1)B(O)O
Synonyms	2-Isobutoxyphenylboronic acid, 833486-92-3, [2-(2-METHYLPROPOXY)PHENYL]BORONIC ACID, SCHEMBL1648162, (2-Isobutoxyphenyl)boronic acid, CTK5F0619, DTXSID10584583, WROPRHAJDSQMRO-UHFFFAOYSA-N, ANW-37677, CI-160, MFCD06411371, AKOS009318396, ZINC169856061, 2-ISOBUTOXY PHENYL BORONIC ACID, AB25289, FS-4229, RTR-025955, BBV-2090303, OR360272, AX8076079, X2287, Boronic acid,B-[2-(2-methylpropoxy)phenyl]-, I04-1969, 2-Isobutoxyphenylboronicacid, C10H15BO3, ACN-044233,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.111g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	194.037g/mol
Monoisotopic Mass	194.111g/mol
Rotatable Bond Count	4
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	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number