AG0012DM

13679-70-4 | 2-Thiophenecarboxaldehyde, 5-methyl-

AG0012DM

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CAS Number	13679-70-4
Catalog Number	AG0012DM(AGN-PC-0JL4LW)
Chemical Name	2-Thiophenecarboxaldehyde, 5-methyl-
EC Number	237-178-6
FEMA Number	3209
IUPAC Name	5-methylthiophene-2-carbaldehyde
InChI	InChI=1S/C6H6OS/c1-5-2-3-6(4-7)8-5/h2-4H,1H3
InChI Key	VAUMDUIUEPIGHM-UHFFFAOYSA-N
MDL Number	MFCD00005434
Molecular Formula	C6H6OS
Molecular Weight	126.1762
NSC Number	87542
SMILES	CC1=CC=C(S1)C=O
UNII	UDF14S002L
Synonyms	13679-70-4, 5-METHYL-2-THIOPHENECARBOXALDEHYDE, 5-Methylthiophene-2-carbaldehyde, 5-Methylthiophene-2-carboxaldehyde, 2-Formyl-5-methylthiophene, 5-Methyl-2-thiophenecarbaldehyde, 2-Thiophenecarboxaldehyde, 5-methyl-, 5-Methyl-2-formylthiophene, 5-Methyl-2-thiophene carboxaldehyde, 5-Methylthiophene-2-aldehyde, 5-Methyl-2-thenaldehyde, 5-Methyl-2-thiophencarboxaldehyde, UNII-UDF14S002L, thiophene, 2-Methyl, 5-formyl, 5-METHYL-2-THIOPHENE-CARBOXALDEHYDE, Thiophen-2-carboxaldehyde, 5-methyl, UDF14S002L, VAUMDUIUEPIGHM-UHFFFAOYSA-N, 5-Methyl-2-carboxaldehyde-thiophene, MFCD00005434, 5-Methyl-2-thiophenecarboxaldehyde, 98%, bread thiophene, FEMA No. 3209, 5-Methly-2-thiophenecarboxaldehyde, NSC87542, EINECS 237-178-6, NSC 87542, PubChem5205, AC1L1VOP, AC1Q2MZL, timtec-bb sbb004249, ACMC-209c9w, DSSTox_CID_27169, DSSTox_RID_82170, DSSTox_GSID_47169, SCHEMBL40949, 5-methyl-2-thiophenealdehyde, 5-methylthiophene carbaldehyde, KSC494G7T, BIDD:GT0340, 5-methyl-thiophene-2-aldehyde, 5-Methyl-2-thienylcarbaldehyde, 5-methyl-2-thiophencarbaldehyde, 5-methyl-2-thiphenecarbaldehyde, CHEMBL3186212, DTXSID0047169, CTK3J4379, KS-00000AYX, 5-methyl-2-thiophenecarboxaldehyd, 5-methyl-thiophene-2-carbaldehyde, ZINC152265, 5-methyl-thiophene-2-carboxaldehyde, BCP27449, Tox21_302636, ANW-20178, NSC-87542, SBB004249, AKOS000120440, AB00417, AC-7208, AN-9222, CS-W018539, LS20392, MCULE-5958342819, RP00826, RTR-004912, TRA0094366, 5-Methyl-2-thiophenecarboxaldehyde, FG, 5-Methylthiophene-2-carboxaldehyde 97%, NCGC00256921-01, AJ-12709, AK-30245, AM803182, AS-15637, CJ-01137, Q106, SC-00934, SY005122, ZB005134, CAS-13679-70-4, DB-003544, ST2406313, TL8000853, TR-004912, FT-0620676, M0911, ST45255793, MFCD00005434 (98%), S-7986, 82918-EP2298758A1, 82918-EP2298759A1, 82918-EP2298772A1, 82918-EP2305664A1, W-108999, 5-Methyl-2-thiophenecarboxaldehyde, analytical standard, F2190-0598, InChI=1/C6H6OS/c1-5-2-3-6(4-7)8-5/h2-4H,1H, Not Available, C6H6OS, C6-H6-O-S, CID61663, 2-THIOPHENECARBONYL,5-METHYL-, A15213, 5-Methylthiophene-2-carboxaldehyde, 98% - 5g 5g, 31555-59-6,

Complexity	92.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.014g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	126.173g/mol
Monoisotopic Mass	126.014g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.3A^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

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