AG008TYD

104163-39-5 | (4-Methyl-2-thienyl)methylamine

AG008TYD

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CAS Number	104163-39-5
Catalog Number	AG008TYD(AGN-PC-0OSYMP)
Chemical Name	(4-Methyl-2-thienyl)methylamine
IUPAC Name	(4-methylthiophen-2-yl)methanamine
InChI	InChI=1S/C6H9NS/c1-5-2-6(3-7)8-4-5/h2,4H,3,7H2,1H3
InChI Key	CKQHNKAVFNDGMK-UHFFFAOYSA-N
MDL Number	MFCD06657973
Molecular Formula	C6H9NS
Molecular Weight	127.2074
SMILES	CC1C=C(CN)SC=1
Synonyms	(4-methylthiophen-2-yl)methanamine, 104163-39-5, (4-methyl-2-thienyl)methylamine, 2-Thiophenemethanamine,4-methyl-, 4-Methyl-2-(aminomethyl)thiophene, 2-(aminomethyl)-4-methylthiophene, 2-Thiophenemethanamine, 4-methyl-, AC1MDTKU, ACMC-1CFBO, SCHEMBL245093, CTK4A2793, (4-Methylthien-2-yl)methylamine, DTXSID40383748, CKQHNKAVFNDGMK-UHFFFAOYSA-N, KS-00002AN5, ZINC4277327, MFCD06657973, SBB085694, AKOS006344721, AB25763, PS-6250, RP00859, AJ-50085, AM802868, RT-020456, Y6895, I09-1003, W-204525, C6H9NS, CID2795528, A1904,

Complexity	74.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	127.046g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	127.205g/mol
Monoisotopic Mass	127.046g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	54.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2735

Certificate of Analysis

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