AG00CTC5

352535-89-8 | 2,3-Dichloro-4-formylphenylboronic acid

AG00CTC5

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CAS Number	352535-89-8
Catalog Number	AG00CTC5(AGN-PC-0RAP91)
Chemical Name	2,3-Dichloro-4-formylphenylboronic acid
IUPAC Name	(2,3-dichloro-4-formylphenyl)boronic acid
InChI	InChI=1S/C7H5BCl2O3/c9-6-4(3-11)1-2-5(7(6)10)8(12)13/h1-3,12-13H
InChI Key	CBQYHKZUDFPONU-UHFFFAOYSA-N
MDL Number	MFCD18968536
Molecular Formula	C7H5BCl2O3
Molecular Weight	218.8298
SMILES	O=CC1=CC=C(B(O)O)C(Cl)=C1Cl
Synonyms	(2,3-dichloro-4-formylphenyl)boronic acid, 352535-89-8, 2,3-DICHLORO-4-FORMYLPHENYLBORONIC ACID, CTK4H4101, DTXSID30698156, ZINC169998923, Boronic acid,(2,3-dichloro-4-formylphenyl)- (9CI),

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.971g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	218.824g/mol
Monoisotopic Mass	217.971g/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	H302-H312-H332
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
UN Code

Certificate of Analysis

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