AG007IN7

338454-17-4 | 3,4-Dihydro-2H-1,4-benzoxazine-6-boronic acid

AG007IN7

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	338454-17-4
Catalog Number	AG007IN7(AGN-PC-0BGI9O)
Chemical Name	3,4-Dihydro-2H-1,4-benzoxazine-6-boronic acid
IUPAC Name	3,4-dihydro-2H-1,4-benzoxazin-6-ylboronic acid
InChI	InChI=1S/C8H10BNO3/c11-9(12)6-1-2-8-7(5-6)10-3-4-13-8/h1-2,5,10-12H,3-4H2
InChI Key	XLLHJXPSEPKXEQ-UHFFFAOYSA-N
MDL Number	MFCD20491430
Molecular Formula	C8H10BNO3
Molecular Weight	178.9809
SMILES	O1CCNC2=CC(B(O)O)=CC=C12
Synonyms	338454-17-4, (3,4-Dihydro-2H-benzo[b][1,4]oxazin-6-yl)boronic acid, 3,4-Dihydro-2H-1,4-benzoxazine-6-boronic acid, AK-94789, (3,4-Dihydro-2H-benzo-[b][1,4]oxazin-6-yl)boronic acid, Boronic acid, B-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-, ACMC-209i38, SCHEMBL3196196, CTK8B1484, KS-00000PKW, DTXSID50718340, ANW-27714, MFCD20491430, AKOS016000312, ZINC169746066, FCH1250074, DS-18002, OR361127, AX8224059, TC-116459, 4CH-011272, ST24020298, V5277, B-9796, D-1801, 3,4-dihydro-2H-1,4-benzoxazin-6-ylboronic acid, C8H10BNO3, (3,4-Dihydro-2H-benzo[b][1,4]oxazin-6-yl)boronicacid,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.075g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	178.982g/mol
Monoisotopic Mass	179.075g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	61.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number