AG00GSYJ

913836-09-6 | 4-BROMO-1-FLUORO-2-NAPHTHALENEBORONIC ACID

AG00GSYJ

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CAS Number	913836-09-6
Catalog Number	AG00GSYJ(AGN-PC-0WAA0X)
Chemical Name	4-BROMO-1-FLUORO-2-NAPHTHALENEBORONIC ACID
IUPAC Name	(4-bromo-1-fluoronaphthalen-2-yl)boronic acid
InChI	InChI=1S/C10H7BBrFO2/c12-9-5-8(11(14)15)10(13)7-4-2-1-3-6(7)9/h1-5,14-15H
InChI Key	MIBHKCPNOCVGJI-UHFFFAOYSA-N
MDL Number	MFCD09027236
Molecular Formula	C10H7BBrFO2
Molecular Weight	268.8748
SMILES	c12c(c(cc(c1F)B(O)O)Br)cccc2
Synonyms	913836-09-6, (4-Bromo-1-fluoronaphthalen-2-yl)boronic acid, 4-Bromo-1-fluoronaphthalene-2-boronic acid, 4-BROMO-1-FLUORO-2-NAPHTHALENEBORONIC ACID, ACMC-209rat, C10H7BBrFO2, CTK5G9469, DTXSID20660266, ZX-AP009076, ANW-39651, MFCD09027236, PC7247, AKOS015835447, ZINC169745599, AB49141, RTR-028700, AX8229986, TR-028700, 4-bromo-1-fluoronaphthalen-2-ylboronic acid, FT-0687784, ST24020532, V9046, (4-bromo-1-fluoro-2-naphthalenyl)boronic acid, A-4663, A843844, I04-1776, (4-bromanyl-1-fluoranyl-naphthalen-2-yl)boronic acid, (4-Bromo-1-fluoronaphthalen-2-yl)boronicacid, 4-BROMO-1-FLUORO-2-NAPHTHALENEBORONICACID,

Complexity	230
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.971g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	268.876g/mol
Monoisotopic Mass	267.971g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^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

Lot Number