基本情報
- 標準SMILES
FCC1CO1- InChIKey
OIFAHDAXIUURLN-UHFFFAOYSA-N- 分子式
- C3H5FO
- 平均分子量
- 76.07 g/mol
- 単同位体質量
- 76.032443
概要
Epifluorohydrin is a clear colorless liquid. (NTP, 1992)
名称と識別子
- 優先名称
- 1,2-Epoxy-3-fluoropropane
- IUPAC
- 2-(fluoromethyl)oxirane
- 現地名
- フルオロメチルオキシラン
- 英語名
- Epifluorohydrin
- 分子式
- C3H5FO
- 分子量
- 76.07
名称と別名
名称をさらに表示
データベース識別子
- CAS
503-09-3- PubChem CID
- 10418
- DTXSID
DTXSID4025244- UNII
- 0ZZ4ROH5IL
- EC Number
- 207-960-1
- Nikkaji
- J1.567I
物性
構造計算による物性
- XLogP
- -0.2
- 極性表面積
- 12.5 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 2
- 回転可能結合数
- 1
- 重原子数
- 5
- 形式電荷
- 0
- 複雑度
- 37.9
実験および物理化学的性質
物理化学的性質
- 沸点
- 85 · 85-86 °C (lit.)
- 比重(密度)
- 1.067 g/mL · 1.067 g/mL at 25 °C (lit.)
- 屈折率
- 20 · n20/D 1.368(lit.)
- 闪点
- 40 °F · 40 °F
- 貯蔵温度
- 0 · 0-6°C
- 外見
- liquid
- 色
- clear
- InChI
- InChI=1S/C3H5FO/c4-1-3-2-5-3/h3H,1-2H2
- InChIKey
- OIFAHDAXIUURLN-UHFFFAOYSA-N
- SMILES
- O1CC1CF
- CAS データベース
- 503 · 503-09-3(CAS DataBase Reference)
- NISTの化学物質情報
- Oxirane, (fluoromethyl)-(503-09-3)
- EPAの化学物質情報
- Epifluorohydrin (503-09-3)
化学的性質
化学的特性clear colourless liquid
安全と法規制
GHS分類
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P361+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Reactivity Profile
A halogenated epoxide. Epoxides are highly reactive. They polymerize in the presence of catalysts or when heated. These polymerization reactions can be violent. Compounds in this group react with acids, bases, and oxidizing and reducing agents. They react, possibly violently with water in the presence of acid and other catalysts. The chlorinated derivative has been shown to be incompatible with aniline, strong oxidizers, sulfuric acid, isopropylamine, zinc, aluminum, iron, etc. see epichlorohydrin.
安全と保護具
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Seal the absorbent paper, as well as any of your clothing which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Wash any surfaces you may have contaminated with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: When working with this chemical, wear a NIOSH-approved full face chemical cartridge respirator equipped with the appropriate organic vapor cartridges. If that is not available, a half face respirator similarly equipped plus airtight goggles can be substituted. However, please note that half face respirators provide a substantially lower level of protection than do full face respirators. (NTP, 1992)
安全データ
- wgk
- 3
- rtecs
- TZ3325000
- ridadr
- UN 2924 3/PG 2
- hs_code
- 2910900090
- risk_code
- 11-23/24/25-34
- hazard_code
- F,T
- hazard_note
- Flammable/Highly Toxic
- safety_code
- 16-26-45-38-36/37/39-33
- hazard_class
- 6.1(a)
- packing_group
- I
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2Skin Corr. 1B
- ストレージクラス
- 3 - Flammable liquids
化学と産業
応用分野
使用Epifluorohydrin is used as a reagent in the synthesis of N-arylphosphoramidates. In addition, it is used in the synthesis of orally bioavailable ALK inhibitors in the treatment of tumors.
一般的な説明Clear colorless liquid.
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