AG0033SR

4653-11-6 | 4-(2-Thienyl)butyric acid

AG0033SR

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CAS Number	4653-11-6
Catalog Number	AG0033SR(AGN-PC-0WA94N)
Chemical Name	4-(2-Thienyl)butyric acid
EC Number	225-090-0
IUPAC Name	4-thiophen-2-ylbutanoic acid
InChI	InChI=1S/C8H10O2S/c9-8(10)5-1-3-7-4-2-6-11-7/h2,4,6H,1,3,5H2,(H,9,10)
InChI Key	VYTXLSQVYGNWLV-UHFFFAOYSA-N
MDL Number	MFCD00005463
Molecular Formula	C8H10O2S
Molecular Weight	170.2288
SMILES	S1C(=CC=C1)CCCC(=O)O
Synonyms	4-(2-thienyl)butyric acid, 4-TByA, 4-(2-Thienyl)butyric acid, 4653-11-6, 4-(thiophen-2-yl)butanoic acid, 2-Thiophenebutanoic acid, 2-Thiophenebutyric acid, 4-(2-Thienyl)butanoic acid, 4-thiophen-2-ylbutanoic acid, 4-Thiophen-2-yl-butyric acid, 4-Thiophen-2-yl-butyricacid, gamma-(alpha-thienyl)butyricacid, CHEBI:40114, VYTXLSQVYGNWLV-UHFFFAOYSA-N, MFCD00005463, .gamma.-(.alpha.-Thienyl)butyric acid, 4TB, zlchem 507, 4-thienylbutyric acid, 2-Thiophenebutanoicacid, 2ay8, 4-(2-thienyl)butyric, ACMC-1AKC8, Epitope ID:167706, 4-thien-2-ylbutanoic acid, AC1L2V4C, AC1Q75DY, 4-(2-thienyl)-butyric acid, BIDD:GT0560, SCHEMBL338927, 4-(2-thiophenyl)butyric acid, AC1Q5W14, 4-(2-Thienyl)butanoic acid #, CHEMBL1230333, CTK1D5981, KS-00000CHJ, DTXSID70196868, ZLC0372, 4-(2-THIENYL)BUTYRICACID, HMS1721F11, ZINC404469, 4-(2-Thienyl)butyric acid, 98%, EINECS 225-090-0, ANW-74083, BBL101114, GEO-02303, STL554910, AKOS001046901, CS-W020036, DB02434, GS-6648, MCULE-2208395467, TRA0076174, VZ27702, AC-29236, AJ-22398, AK-84520, SY005888, DB-031250, ST2418046, TC-063452, A1328, FT-0635380, ST50307951, Z5528, MFCD00005463 (98%), C-5325, I09-1790, I09-2090, J-640130, J-800134, InChI=1/C8H10O2S/c9-8(10)5-1-3-7-4-2-6-11-7/h2,4,6H,1,3,5H2,(H,9,10, N-(4-Vinylphenyl)maleinimide, 5-Bromo-3,4-diaminopyridine, C8H10O2S, CID78386, AR-1E5598, MFCD01692479, 108-95-2, 4653-08-1, 4919-11-3,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.04g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.226g/mol
Monoisotopic Mass	170.04g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	65.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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

Lot Number