AG003IN2

105184-38-1 | 3,5-Difluorophenylacetic acid

AG003IN2

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CAS Number	105184-38-1
Catalog Number	AG003IN2(AGN-PC-0JMUIR)
Chemical Name	3,5-Difluorophenylacetic acid
IUPAC Name	2-(3,5-difluorophenyl)acetic acid
InChI	InChI=1S/C8H6F2O2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12)
InChI Key	IGGNSAVLXJKCNH-UHFFFAOYSA-N
MDL Number	MFCD00010316
Molecular Formula	C8H6F2O2
Molecular Weight	172.1288
SMILES	O=C(O)CC1=CC(F)=CC(F)=C1
Synonyms	3,5-Difluorophenylacetic acid, 105184-38-1, 2-(3,5-difluorophenyl)acetic acid, 3,5-Difluorophenylaceticacid, 3,5-difluorobenzeneacetic acid, (3,5-difluorophenyl)acetic acid, (3,5-difluoro-phenyl)-acetic acid, Benzeneacetic acid, 3,5-difluoro-, MFCD00010316, 3,5-difluorophenyl acetic acid, IGGNSAVLXJKCNH-UHFFFAOYSA-N, 3,5-Difluorophenylac, PubChem4160, ACMC-1C6GR, AC1L3R5U, AC1Q74WR, AC1Q74WS, SCHEMBL8512, 3,5difluorophenylacetic acid, KSC181O9F, 3,5 difluorophenylacetic acid, 3,5-difluoro phenylacetic acid, TPC-I101, Jsp000496, RARECHEM AL BO 0631, CTK0I1792, KS-00000CEK, TIMTEC-BB SBB006660, DTXSID40146996, Benzeneaceticacid, 3,5-difluoro-, 3,5-di-fluoro-phenyl acetic acid, ZINC164762, ACT12807, JRD-0005, ANW-15180, BBL027779, CD-368, SBB006660, STK801470, 3,5-Difluorophenylacetic acid, 99%, 3,5-DIIFLUOROPHENYLACETIC ACID, AKOS005063831, AB01029, AC-7445, AM62259, AN-1247, AS01969, CM13693, MCULE-2148465033, PS-8675, RL00240, RTC-062280, TF10360, TRA0007278, VZ25778, AJ-16279, AK-32749, BR-32749, L450, SC-65103, SY004255, AB0014712, DB-022056, ST2417296, TC-062280, TL8000200, 4CH-003226, CS-0007716, D3462, FT-0614611, ST50307028, MFCD00010316 (98%), Unavailable - See ASDI_CatNo 500010249, S-1749, I01-2762, J-511331, InChI=1/C8H6F2O2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12, C8H6F2O2, CID145424, ACN-050242, A1976, 3,5-Difluorophenylacetic acid, 99% - 25G 25g, 110-85-0, 209982-91-2,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.034g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.131g/mol
Monoisotopic Mass	172.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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