AG002PB5

247564-55-2 | 4,7-Difluoroindole

AG002PB5

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CAS Number	247564-55-2
Catalog Number	AG002PB5(AGN-PC-0KKZ3E)
Chemical Name	4,7-Difluoroindole
IUPAC Name	4,7-difluoro-1H-indole
InChI	InChI=1S/C8H5F2N/c9-6-1-2-7(10)8-5(6)3-4-11-8/h1-4,11H
InChI Key	WXDUAQYBARJXOQ-UHFFFAOYSA-N
MDL Number	MFCD01075214
Molecular Formula	C8H5F2N
Molecular Weight	153.1288
SMILES	FC1=CC=C(F)C2=C1NC=C2
Synonyms	4,7-difluoro-1H-indole, 4,7-DIFLUOROINDOLE, 247564-55-2, 1H-INDOLE, 4,7-DIFLUORO-, PubChem7181, AC1MCTY4, 1H-Indole,4,7-difluoro-, SCHEMBL2542070, 4,7-bis(fluoranyl)-1H-indole, CTK4F4329, DTXSID20381101, WXDUAQYBARJXOQ-UHFFFAOYSA-N, 1H-Indole,4,7-difluoro-(9CI), BCP06181, KS-00000J5Q, ZINC8698088, ANW-52561, CD-855, MFCD01075214, SBB086887, AKOS006230406, CM14078, LS20301, MB01667, QC-3446, RD-0159, VI30032, AJ-57928, AS-30896, CJ-13336, SC-02849, AB0060540, AB1005645, TX-016895, 4CH-009778, FT-0658510, ST24028703, D-2515, A817475, I10-0170, Z1741979796, ZINC02572574, CID2778734, MP-1727,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.039g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.132g/mol
Monoisotopic Mass	153.039g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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