AG00ECHL

619-03-4 | 3,4-Dibromobenzoic acid

AG00ECHL

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CAS Number	619-03-4
Catalog Number	AG00ECHL(AGN-PC-0JTZGM)
Chemical Name	3,4-Dibromobenzoic acid
IUPAC Name	3,4-dibromobenzoic acid
InChI	InChI=1S/C7H4Br2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)
InChI Key	DHMPDNLGFIBQCK-UHFFFAOYSA-N
MDL Number	MFCD00094403
Molecular Formula	C7H4Br2O2
Molecular Weight	279.9135
SMILES	O=C(O)C1=CC=C(Br)C(Br)=C1
Synonyms	3,4-Dibromobenzoic acid, 619-03-4, Benzoic acid, 3,4-dibromo-, DHMPDNLGFIBQCK-UHFFFAOYSA-N, 3,4-Dibrom-benzoesaure, AC1LDQA9, SCHEMBL588825, 3,4-bis(bromanyl)benzoic acid, CTK2D0485, KS-00000OYW, DTXSID80347662, AC1Q7346, MFCD00094403, ZINC19865563, AKOS000298634, AS03516, CD-1619, CM12638, QC-3923, AJ-75514, AK-64921, DS-15680, SY034395, AB0065312, ST2410245, 4CH-016258, FT-0658227, MFCD00094403 (95%), A833477, I01-1836, CID624397,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	279.856g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	279.915g/mol
Monoisotopic Mass	277.858g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number