AG003RVB

403-33-8 | Methyl 4-fluorobenzoate

AG003RVB

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CAS Number	403-33-8
Catalog Number	AG003RVB(AGN-PC-0BZ2R6)
Chemical Name	Methyl 4-fluorobenzoate
EC Number	206-956-7
IUPAC Name	methyl 4-fluorobenzoate
InChI	InChI=1S/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChI Key	MSEBQGULDWDIRW-UHFFFAOYSA-N
MDL Number	MFCD00017959
Molecular Formula	C8H7FO2
Molecular Weight	154.1384
NSC Number	102770
SMILES	O=C(OC)C1=CC=C(F)C=C1
Synonyms	Methyl 4-fluorobenzoate, 403-33-8, 4-Fluorobenzoic Acid Methyl Ester, Methyl p-fluorobenzoate, Methyl 4-Fluorobenzoic Acid, Benzoic acid, 4-fluoro-, methyl ester, METHYL4-FLUOROBENZOATE, Methyl 4-fluorobenzoate, 98%, MSEBQGULDWDIRW-UHFFFAOYSA-N, MFCD00017959, 4-fluoro-benzoic acid methyl ester, EINECS 206-956-7, PubChem3566, methyl-4-fluorobenzoate, ACMC-1AEF0, ASISCHEM P32019, SCHEMBL63811, KSC490A7H, 4-F-C6H4-COOCH3, AC1L28J8, AC1Q5Z92, PARAGOS 390197, Jsp006981, RARECHEM AL BF 0076, CTK3J0073, KS-00000BBN, DTXSID40193309, p-Fluorobenzoic acid, methyl ester, ZINC388132, 4-fluoro benzoic acid methyl ester, 4-Fluorobenzoic acid, methyl ester, ANW-29372, NSC102770, SBB053694, AKOS000295905, AM61512, AS01318, Benzoic acid, p-fluoro-, methyl ester, CS-W007781, MCULE-8138868311, NSC-102770, PF10976, PS-8880, RTR-033266, TRA0012316, VZ32652, P-FLUOROBENZOIC ACID METHYL ESTER, AC-15550, AJ-20446, AK-45398, AN-44783, BR-45398, CJ-03125, SC-04295, ZB011308, AB0011781, DB-013253, ST2413408, TL8002934, TR-033266, F0403, FT-0618511, ST50824452, M-7238, I01-2177, W-106363, Benzoicacid, 4-fluoro-, methyl ester, radical ion(1+) (9CI), InChI=1/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H, 898598-33-9, Benzoic acid, methyl ester, C8H7FO2, C8-H7-F-O2, CID67878, AR-1J6114, Methyl 4-fluorobenzoate, 99% - 100G 100g, 4257-78-7,

Complexity	139
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.043g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.14g/mol
Monoisotopic Mass	154.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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