AG00I6HD

332398-52-4 | 4-Formylnaphthalene-1-boronic acid

AG00I6HD

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CAS Number	332398-52-4
Catalog Number	AG00I6HD(AGN-PC-0KKVFC)
Chemical Name	4-Formylnaphthalene-1-boronic acid
IUPAC Name	(4-formylnaphthalen-1-yl)boronic acid
InChI	InChI=1S/C11H9BO3/c13-7-8-5-6-11(12(14)15)10-4-2-1-3-9(8)10/h1-7,14-15H
InChI Key	KBHGTTWVFRLPRO-UHFFFAOYSA-N
MDL Number	MFCD01632205
Molecular Formula	C11H9BO3
Molecular Weight	199.9984
SMILES	O=CC1=C2C=CC=CC2=C(B(O)O)C=C1
Synonyms	332398-52-4, (4-formylnaphthalen-1-yl)boronic Acid, (4-Formyl-1-naphthalene)boronic acid, 4-Formylnaphthalene-1-boronic acid, 4-formylnaphthalen-1-ylboronic acid, Boronic acid, (4-formyl-1-naphthalenyl)-, MFCD01632205, AC1MCMXK, ACMC-209hzm, Boronic acid, B-(4-formyl-1-naphthalenyl)-, SCHEMBL257891, C11H9BO3, 4-formyl-1-naphthylboronic acid, CTK1C1864, DTXSID80378451, 4-Formyl-1-naphthaleneboronic acid, ANW-27584, (4-formyl-1-naphthalenyl)boronic acid, AKOS004116435, ZINC169745149, AB09475, (4-methanoylnaphthalen-1-yl)boronic acid, N888, 4 - Formyl - 1 - naphthaleneboronic acid, Boronicacid, B-(4-formyl-1-naphthalenyl)-, TR-013930, FT-0690442, B-8125, A821687, BORONICACID, CID2773424,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.064g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	200g/mol
Monoisotopic Mass	200.064g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^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

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