AG003368

7345-79-1 | 2-Bromocinnamic acid

AG003368

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CAS Number	7345-79-1
Catalog Number	AG003368(AGN-PC-0OHADO)
Chemical Name	2-Bromocinnamic acid
EC Number	231-353-0
IUPAC Name	(E)-3-(2-bromophenyl)prop-2-enoic acid
InChI	InChI=1S/C9H7BrO2/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6H,(H,11,12)/b6-5+
InChI Key	OMHDOOAFLCMRFX-AATRIKPKSA-N
MDL Number	MFCD00016836
Molecular Formula	C9H7BrO2
Molecular Weight	227.0547
NSC Number	407679
SMILES	BrC1=C(C=CC(=O)O)C=CC=C1
Synonyms	2-Bromocinnamic acid, 7345-79-1, trans-2-Bromocinnamic acid, 7499-56-1, o-Bromocinnamic acid, 3-(2-Bromophenyl)acrylic acid, (E)-3-(2-Bromophenyl)acrylic acid, bromocinnamic acid,2-, (2E)-3-(2-bromophenyl)prop-2-enoic acid, 3-(2-bromo-phenyl)-acrylic acid, (E)-3-(2-bromophenyl)prop-2-enoic acid, (2E)-3-(2-BROMOPHENYL)ACRYLIC ACID, 2-Propenoic acid, 3-(2-bromophenyl)-, (E)-, OMHDOOAFLCMRFX-AATRIKPKSA-N, MFCD00016836, (E)-3-(2-Bromophenyl)propenoic acid, 2-PROPENOIC ACID, 3-(2-BROMOPHENYL)-, (2E)-, 3-(2-bromophenyl)prop-2-enoic acid, o-Bromzimtsaure, EINECS 231-353-0, PubChem3756, 2-bromo cinnamic acid, AC1LELU0, Cinnamic acid, o-bromo-, 2-Bromobenzeneacrylic acid, RARECHEM BK HC T304, SCHEMBL1049717, SCHEMBL1049718, OMHDOOAFLCMRFX-AATRIKPKSA-, OTAVA-BB 1512694, trans-2-Bromocinnamic acid, 95%, ALBB-011738, ZINC4977543, BBL017155, NSC407679, SBB050858, STK441381, (E)-3-(2-bromophenyl)-acrylic acid, AKOS000198561, AS03176, FS-3823, NSC-407679, RP17547, RTR-023848, NCGC00337705-01, AJ-52759, BC002562, CC-09669, H290, SC-81630, SY014291, (E)-3-(2-bromophenyl)-2-propenoic acid, (2E)-3-(2-bromophenyl)-2-propenoic acid, AB0012961, DB-020674, RT-004586, TR-023848, CS-0063883, ST24022527, ST45082042, EN300-17783, B-5013, 2-Propenoic acid,3-(2-bromophenyl)-, (2E)-, AB01329261-02, 345B791, A837836, I01-6612, I01-9549, J-501874, InChI=1/C9H7BrO2/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6H,(H,11,12)/b6-5+, 2-Bromocinnamicacid, p-Bromocinnamic acid, 4-Bromocinnamic acid, bromocinnamic acid,4-, C9H7BrO2, trans-4-Bromocinnamic acid, RARECHEM BK HD C006, C9-H7-Br-O2, 3-(4-bromophenyl)acrylic acid, Cinnamic acid, o-bromo-, (E)-, OTAVA-BB 1512693, CID688321, 3-(4-bromophenyl)prop-2-enoic acid, ACN-042048, (E)-3-(4-Bromo-phenyl)-acrylic acid, 2-Bromocinnamic acid, 98% - 1G 1g, 2-Propenoic acid, 3-(2-bromophenyl)-, B1943, (2E)-3-(4-BROMOPHENYL)ACRYLIC ACID, 2-Propenoic acid, 3-(4-bromophenyl)-, (2E)-,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	225.963g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	227.057g/mol
Monoisotopic Mass	225.963g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number