3-ブロモ-1-プロパノール

3-Bromo-1-propanol

HCID 12308CAS 627-18-9

基本情報

標準SMILES
OCCCBr
InChIKey
RQFUZUMFPRMVDX-UHFFFAOYSA-N
分子式
C3H7BrO
平均分子量
138.99 g/mol
単同位体質量
137.96802694

概要

3-bromo-1-propanol is a clear colorless liquid. (NTP, 1992)

名称と識別子

優先名称
3-Bromo-1-propanol
IUPAC
3-bromopropan-1-ol
現地名
3-ブロモ-1-プロパノール
英語名
3-Bromo-1-propanol
分子式
C3H7BrO
分子量
138.99

名称と別名

3-Bromo-1-propanol627-18-9Trimethylene bromohydrin1-Propanol, 3-bromo-3-BROMOPROPANOL3-Hydroxypropyl bromide1-Bromo-3-propanolCCRIS 59791-Bromo-3-hydroxypropaneUNII-3T4AXH68FHDTXSID3024657EINECS 210-986-6
名称をさらに表示
3-ブロモ-1-プロパノール3-ブロモ-1-プロパノ-ル3-ブロモ-1-プロパノール 臭化物トリメチレンブロモヒドリン3‐ブロモ‐1‐プロパノール3-ブロモプロパン-1-オール3-bromoethanol3-bromo-1-propano3-Brumo-1-propanol3-bromo-propan-1-ol
3T4AXH68FHBRN 0969160AI3-523153-Bromopropanol-(1)DTXCID904657BROMO-1-PROPANOL, 3-4-01-00-01446 (Beilstein Handbook Reference)3-BROMOPROPYL ALCOHOL

データベース識別子

CAS
627-18-9
PubChem CID
12308
DTXSID
DTXSID3024657
ChEMBL
CHEMBL466545
ChEBI
CHEBI:144333
UNII
3T4AXH68FH
EC Number
210-986-6
Nikkaji
J3.012K

物性

構造計算による物性

XLogP
0.7
極性表面積
20.2 Ų
水素結合供与体数
1
水素結合受容体数
1
回転可能結合数
2
重原子数
5

実験および物理化学的性質

Chemical ClassesOther Classes -> Halogenated Alcohols
SpringerMaterials PropertiesDensity
Density1.5374 at 68 °F (NTP, 1992) - Denser than water; will sink
Solubility50 to 100 mg/mL at 70 °F (NTP, 1992)
Flash Point · 2 件

201 °F (NTP, 1992)

201 °F

Boiling Point293 to 298 °F at 760 mmHg (NTP, 1992)

物理化学的性質

沸点
62 °C/5 · 62 °C/5 mmHg (lit.)
比重(密度)
1.537 g/mL · 1.537 g/mL at 25 °C (lit.)
蒸気圧
0.13 hPa · 0.13 hPa (20 °C)
屈折率
20 · n20/D 1.488(lit.)
闪点
215 °F · 215 °F
貯蔵温度
2 · 2-8°C

化学的性質

化学的特性colourless liquid

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (78.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 51 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Chemical: 1-Propanol, 3-bromo-

3-Bromo-1-propanol: Does not have an individual approval but may be used under an appropriate group standard

Fire HazardsThis chemical is combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Related compounds are eye, skin, and mucous membrane irritants and cause severe lung injury if aspirated.
Hazards SummarySkin irritant; [Quick CPC] Can cause severe lung injury if aspirated; [CAMEO] An irritant that may cause serious eye injury; Harmful by ingestion; [Aldrich MSDS] See 1-Chloro-2-propanol.
Reactive GroupAlcohols and Polyols
Reactivity AlertsHighly Flammable

安全と保護具

Fire FightingIt is combustible. Fires involving this compound can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

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 · 1 件

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)MINIMUM PROTECTIVE CLOTHING: If Tyvek-type disposable protective clothing is not worn during handling of this chemical, wear disposable Tyvek-type sleeves taped to your gloves.

安全データ

F
8
wgk
3
tsca
TSCA listed
rtecs
UA7385000
hs_code
29055910
risk_code
22-41-36/37/38

化学と産業

用途と製造

General Manufacturing Information1-Propanol, 3-bromo-: ACTIVE
応用分野 · 3 件

用途有機合成原料。

使用3-Bromo-1-propanol is used in the synthesis of fluorescent halide-sensitive quinolinium dyes, chiral, quaternary prolines through cyclization of quaternary amino acids and molten salt-polymers. It is utilized for the study of micellar media and in microemulsions based on cationic or a nonionic surfactant by reacting with phenols. It acts as a grafting agent in the synthesis of recyclable reagents and an intermediate in the synthesis of organic molecules.

一般的な説明Clear colorless liquid.

サプライヤー50 社

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