AG003PJQ

51851-79-7 | Diisopropyl allylboronate

AG003PJQ

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CAS Number	51851-79-7
Catalog Number	AG003PJQ(AGN-PC-0091VS)
Chemical Name	Diisopropyl allylboronate
IUPAC Name	di(propan-2-yloxy)-prop-2-enylborane
InChI	InChI=1S/C9H19BO2/c1-6-7-10(11-8(2)3)12-9(4)5/h6,8-9H,1,7H2,2-5H3
InChI Key	LWPLTONTMJTRJL-UHFFFAOYSA-N
MDL Number	MFCD15072157
Molecular Formula	C9H19BO2
Molecular Weight	170.0570
SMILES	C(C=C)B(OC(C)C)OC(C)C
Synonyms	Diisopropyl Allylboronate, 51851-79-7, Allylboronic Acid Diisopropyl Ester, bis(propan-2-yl) (prop-2-en-1-yl)boronate, Boronic acid, 2-propenyl-, bis(1-methylethyl) ester, ACMC-209kwc, SCHEMBL838617, CTK4J4978, DTXSID60465712, ANW-31354, MFCD15072157, AKOS015838926, ZINC195918296, AS-55613, TR-036954, D3738, Dipropan-2-yloxy-prop-2-enyl-borane, CID11435180,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.148g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.059g/mol
Monoisotopic Mass	170.148g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H226-H315-H319
Packing Group
Precautionary statements	P210-P233-P240-P241+P242+P243-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501
UN Code	\N

Certificate of Analysis

Lot Number