AG001LD0

14903-90-3 | 2-Furancarboxylic acid, 3-bromo-

AG001LD0

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CAS Number	14903-90-3
Catalog Number	AG001LD0(AGN-PC-0JTO0U)
Chemical Name	2-Furancarboxylic acid, 3-bromo-
IUPAC Name	3-bromofuran-2-carboxylic acid
InChI	InChI=1S/C5H3BrO3/c6-3-1-2-9-4(3)5(7)8/h1-2H,(H,7,8)
InChI Key	UZBGSJZFBUOJNE-UHFFFAOYSA-N
MDL Number	MFCD00092761
Molecular Formula	C5H3BrO3
Molecular Weight	190.9795
SMILES	OC(=O)C1=C(Br)C=CO1
Synonyms	3-bromofuran-2-carboxylic acid, 14903-90-3, 3-Bromo-2-furoic acid, Furancarboxylic acid, bromo-, 3-bromo-2-furancarboxylic acid, 3-bromo-furan-2-carboxylic acid, UZBGSJZFBUOJNE-UHFFFAOYSA-N, 2-furancarboxylic acid, 3-bromo-, MFCD00092761, 34364-34-6, bromofuroic acid, 3-Bomo-2-furoic acid, AC1LCRL0, AI-942/25121026, SCHEMBL1254887, CTK1B1211, 3-bromanylfuran-2-carboxylic acid, ZINC334387, KS-00000NI2, SBB065967, AKOS012907124, AB03324, CB-3572, CS-W021884, DS-5002, NE11224, AC-25745, AJ-19660, AK110945, SC-50264, DB-022382, ST2404996, 4CH-019180, AM20080374, FT-0654982, Z5464, EN300-71509, A808835, I04-0981, J-512100, Z1357774283, InChI=1/C5H3BrO3/c6-3-1-2-9-4(3)5(7)8/h1-2H,(H,7,8, 1-2 weeks, C5H3BrO3, 3-bromofuran-2-carboxylicacid, CID605479, ACN-052372, C3206,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.927g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.98g/mol
Monoisotopic Mass	189.927g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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