AG002GHX

1878-68-8 | 4-Bromophenylacetic acid

AG002GHX

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CAS Number	1878-68-8
Catalog Number	AG002GHX(AGN-PC-0JLBRC)
Chemical Name	4-Bromophenylacetic acid
EC Number	217-523-7
IUPAC Name	2-(4-bromophenyl)acetic acid
InChI	InChI=1S/C8H7BrO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChI Key	QOWSWEBLNVACCL-UHFFFAOYSA-N
MDL Number	MFCD00930856
Molecular Formula	C8H7BrO2
Molecular Weight	215.0440
NSC Number	14358
SMILES	O=C(O)Cc1ccc(cc1)Br
Synonyms	4-Bromophenylacetic acid, 1878-68-8, 2-(4-Bromophenyl)acetic acid, (4-Bromophenyl)acetic acid, 4-Bromophenyl acetic acid, P-BROMOPHENYLACETIC ACID, 4-Bromobenzeneacetic acid, Benzeneacetic acid, 4-bromo-, C8H7BrO2, (p-Bromophenyl)acetic acid, MFCD00004342, Acetic acid, (p-bromophenyl)-, p-Bromphenylessigsaure [German], Acide p-bromophenylacetique [French], EINECS 217-523-7, NSC 14358, 4-bromo-phenyl-acetic acid, BRN 0972146, QOWSWEBLNVACCL-UHFFFAOYSA-N, 4-Bromophenylacetic acid, 99%, p-Bromphenylessigsaure, Acide p-bromophenylacetique, PubChem4246, 4-bromophenylaceticacid, 4bromophenylacetic acid, AC1L2MDI, 4-bromo-phenylacetic acid, 4-bromophenyl-acetic acid, ACMC-1CH1Q, 4-bromo-benzeneacetic acid, 4-bromo phenyl acetic acid, 4-bromo-phenyl acetic acid, ASISCHEM D13369, Benzeneaceticacid, 4-bromo-, (4-bromophenyl)-acetic acid, SCHEMBL29257, 3-09-00-02275 (Beilstein Handbook Reference), 4-Bromophenylacetic acid acid, KSC175S1N, (4-bromo-phenyl)-acetic acid, AC1Q74X5, CHEBI:1790, RARECHEM AL BO 0130, 4-Bromophenylacetic acid, 98%, DTXSID2062032, CTK0H5916, TIMTEC-BB SBB042842, OTAVA-BB 1287087, HMS1788P11, WT282, ZINC167159, ACT01177, CS-D0933, NSC14358, STR02794, AKOS BBS-00007001, ANW-23362, BBL013908, HTS001484, NSC-14358, SBB042842, STL061090, AKOS000150899, 1878-68-8 4-bromophenylacetic acid, AB00367, AC-4183, AM86716, AN-1083, AS00507, CCG-255918, LS10304, MCULE-8300414581, PS-4698, RP26872, RTR-008690, TRA0091438, AJ-16609, AK-45378, BC002738, BC203407, BR-45378, LS-11168, SC-02020, SY001685, AB1003219, ST2418223, TL8001523, TR-008690, FT-0617912, ST50308544, MFCD00004342 (98%), A21790, C-4559, C03076, I01-0865, W-107764, F2191-0031, (p-bromophenyl)-aceticaci;Aceticacid,(p-bromophenyl)-;Benzeneacetic acid, 4-bromo-, InChI=1/C8H7BrO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11, null, 4-Bromophenylacetate, 4-Bromophenyl acetate, (p-Bromphenyl)essigsaure, (4-Bromphenyl)ethansaure, C8-H7-Br-O2, CID74654, ACN-040296, B1296, 4-Bromophenylacetic acid, 99% - 100G 100g, 110-63-4, 1927-95-3, 586-76-5, 913835-32-2,

Complexity	139
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.963g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.046g/mol
Monoisotopic Mass	213.963g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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

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