trans-3,4-Difluorocinnamic acid (CAS 112897-97-9) — formula C9H6F2O2, molecular weight 184.14; category organic chemicals.
| CAS Number | 112897-97-9 |
|---|---|
| Molecular Formula | C9H6F2O2 |
| Molecular Weight | 184.14 |
| LogP | 2.1 |
| Category | Organic Chemicals |
trans-3,4-Difluorocinnamic acid is a carbon-based organic compound with CAS registry number 112897-97-9 and molecular formula C9H6F2O2 (molecular weight 184.14), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 112897-97-9
Its molecular formula C9H6F2O2 comprises 9 C, 6 H, 2 F, 2 O atoms.
Also known as: trans-3,4-Difluorocinnamic acid · 反式3,4-二氟肉桂酸 · 3,4-Difluorocinnamic acid
Category: organic chemicals
The CAS registry number of trans-3,4-Difluorocinnamic acid is 112897-97-9.
Molecular formula C9H6F2O2, molecular weight 184.14.
It is also registered under: trans-3,4-Difluorocinnamic acid, 反式3,4-二氟肉桂酸, 3,4-Difluorocinnamic acid.
Category: Organic Chemicals.
Independent reference data for trans-3,4-Difluorocinnamic acid (CAS 112897-97-9), compiled from public chemistry databases.
| CAS Registry Number | 112897-97-9 |
|---|---|
| PubChem CID | 2733300 |
| Molecular formula | C9H6F2O2 |
| IUPAC name | (E)-3-(3,4-difluorophenyl)prop-2-enoic acid |
| UNII (FDA) | ST50826856 |
| Molecular Weight | 184.14 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 184.03358575 |
| Monoisotopic Mass | 184.03358575 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 13 |
trans-3,4-Difluorocinnamic acid; 112897-97-9; DTXSID701347531; RefChem:898774; DTXCID201776268; 623-374-2; 3,4-Difluorocinnamic acid; (E)-3-(3,4-difluorophenyl)acrylic acid; (E)-3-(3,4-difluorophenyl)prop-2-enoic acid; MFCD00010320; (2E)-3-(3,4-difluorophenyl)prop-2-enoic acid; 3-(3,4-Difluorophenyl)acrylic acid; 3-(3,4-Difluoro-phenyl)acrylic acid; AKOS025310637; CS-W017014; D4161
| Reported hazard statements | H315 (100%), H319 (100%), H335 (97.9%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3,4-Difluorocinnamic acid · CAS 112897-97-9 · C9H6F2O2. UNII ST50826856.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3,4-二氟肉桂酸