1. Introduction of1-Bromo-3,5-difluorobenzene The 1-Bromo-3,5-difluorobenzene, with its CAS NO461-96-1, is a kind of Colorless …
1. Introduction of 1-Bromo-3,5-difluorobenzene
The 1-Bromo-3,5-difluorobenzene, with its CAS NO 461-96-1, is a kind of Colorless Transparent Liquid. It has synonyms of 1-bromo-3,5-difluoro-benzene;3,5-Difluorobromobenzene;3,5-Difluoro-1-Bromobenzene;1-Bromo-3,5-Difluorobromobenzene;Benzene, 1-bromo-3,5-difluoro-;1,3-Difluoro-5-bromobenzene and 3,5-Difluoro-Bromobenzene. 1-Bromo-3,5-difluorobenzene should be stored in shady and cool warehouse.
2. Properties of 1-Bromo-3,5-difluorobenzene
(1) XLogP3-AA 2.8 (2) H-Bond Acceptor 2 (3) Exact Mass 191.938619
(4) MonoIsotopic Mass 191.938619 (5) Heavy Atom Count 9 (6) Complexity 87.1
(7) Covalently-Bonded Unit Count 1 (8) Feature 3D Hydrophobe Count 1 (9) Feature 3D Ring Count 1
(10) Conformer Sampling RMSD 0.4 (11) CID Conformer Count 1
3. Structure descriptors of 1-Bromo-3,5-difluorobenzene
IUPAC Name: 1-bromo-3,5-difluorobenzene
InChI: InChI=1S/C6H3BrF2/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKey: JHLKSIOJYMGSMB-UHFFFAOYSA-N
Canonical SMILES : C1=C(C=C(C=C1F)Br)F
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