AG003JG9

452-77-7 | 3-Fluoro-4-methylaniline

AG003JG9

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CAS Number	452-77-7
Catalog Number	AG003JG9(AGN-PC-0JK9CN)
Chemical Name	3-Fluoro-4-methylaniline
EC Number	207-212-4
IUPAC Name	3-fluoro-4-methylaniline
InChI	InChI=1S/C7H8FN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H3
InChI Key	MGRHBBRSAFPBIN-UHFFFAOYSA-N
MDL Number	MFCD00007762
Molecular Formula	C7H8FN
Molecular Weight	125.1435
NSC Number	57470
SMILES	NC1=CC=C(C)C(F)=C1
Synonyms	3-Fluoro-4-methylaniline, 452-77-7, 4-Amino-2-fluorotoluene, 3-Fluoro-p-toluidine, 2-Fluoro-4-aminotoluene, 2-fluoro-4-amino-toluene, Benzenamine, 3-fluoro-4-methyl-, p-TOLUIDINE, 3-FLUORO-, 3-fluoro-4-methylphenylamine, EINECS 207-212-4, MFCD00007762, NSC 57470, 3-fluoro-4-methyl-aniline, BRN 2715987, Benzenamine, 3-fluoro-4-methyl- (9CI), MGRHBBRSAFPBIN-UHFFFAOYSA-N, 3-FLUORO-4-METHYLBENZENEAMINE, NSC57470, 3-Fluor-p-toluidin, PubChem1509, AC1Q2FFP, 3-fluoro-4-methyl aniline, AC1L1U6K, AC1Q4N6V, WLN: ZR CF D1, ACMC-1AD14, 3-fluoro-4-methylbenzenamine, KSC494A2B, SCHEMBL347254, 3-fluoro-4-methyl-phenylamine, CTK3J4020, TIMTEC-BB SBB028219, DTXSID80196430, 3-Fluoro-4-methylaniline, 99%, ZINC164593, ACT11489, ANW-30251, BBL100253, NSC-57470, SBB028219, STL195539, AKOS000113236, AC-3689, AM61996, AS00436, CM11465, LS10457, MCULE-9063314106, PF10448, PS-9194, RTR-032956, TRA0025532, VF10127, KS-000009V1, AJ-16227, AK-35221, AN-12747, BR-35221, CJ-02181, SC-04625, TL806259, ZB008216, AB0011130, DB-024065, LS-154378, ST2417703, TR-032956, F0440, FT-0615749, ST51038066, Y-9060, I01-1064, W-106145, F2190-0475, Z234894919, InChI=1/C7H8FN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H, C7H8FN, C7-H8-F-N, CID9957, AR-1L2547, ACN-055996, A7141, 4-12-00-01981 (Beilstein Handbook Reference), 3-Fluoro-4-methylaniline, 99% - 25G 25g, 4869-71-0,

Complexity	94.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	125.064g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	125.146g/mol
Monoisotopic Mass	125.064g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H227-H300-H312+H332-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P310-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

Lot Number