AG005SEV

76008-73-6 | Ethyl 5-bromo-2-chlorobenzoate

AG005SEV

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CAS Number	76008-73-6
Catalog Number	AG005SEV(AGN-PC-0JMU3R)
Chemical Name	Ethyl 5-bromo-2-chlorobenzoate
EC Number	616-279-2
IUPAC Name	ethyl 5-bromo-2-chlorobenzoate
InChI	InChI=1S/C9H8BrClO2/c1-2-13-9(12)7-5-6(10)3-4-8(7)11/h3-5H,2H2,1H3
InChI Key	AMGWDYLEMSMUIO-UHFFFAOYSA-N
MDL Number	MFCD00013635
Molecular Formula	C9H8BrClO2
Molecular Weight	263.5156
SMILES	CCOC(=O)C1=C(Cl)C=CC(Br)=C1
Synonyms	Ethyl 5-bromo-2-chlorobenzoate, 76008-73-6, 5-Bromo-2-chlorobenzoic Acid Ethyl Ester, ethyl5-bromo-2-chlorobenzoate, Benzoic acid, 5-bromo-2-chloro-, ethyl ester, AMGWDYLEMSMUIO-UHFFFAOYSA-N, MFCD00013635, PubChem3702, AC1L3PUF, ACMC-1BB9D, AC1Q32YM, AC1Q33XG, SCHEMBL320371, Ethyl-5-bromo-2-chlorobenzoate, CTK3J5083, ethyl 5-bromo-2-chloro-benzoate, DTXSID90226919, a-Ethyl 5-bromo-2-chlorobenzoate, ATTERCOP-CHM AT115127, Ethyl 5-bromo2-chlorobenzaldehyde, ZINC157285, ACN-S004272, ACT08387, KS-00000FQ6, STR08019, ANW-36716, LABOTEST-BB LT01148052, SBB053793, AKOS007930047, AC-3905, AS03595, Ethyl 5-Bromo-2-chlorobenzoate, 98%, MCULE-6258123011, PS-7346, RTC-020818, VZ30094, 3-bromo-6-chlorobenzoic acid ethyl ester, AJ-14975, AK-29515, AN-12530, BC002526, FS000829, SY012257, ZB006631, 5-Bromo-2-chloro-benzoic acid ethyl ester, 5-bromo-2-chloro-benzoic acid, ethyl ester, AB1008313, DB-013530, TC-020818, FT-0620079, FT-0648050, ST24030640, ST50307301, MFCD00013635 (95%), A19962, I01-4961, null, C9H8BrClO2, 2-Chloro-5-bromobenzoic acid, 5-Bromo-2-chlorobenzoic acid, ATTERCOP-CHM AT111675, CID144749, ZINC00157285, BROMO(5-)-2-CHLOROBENZOIC ACID, R805, B2255,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.94g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.515g/mol
Monoisotopic Mass	261.94g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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