1-メチルシクロブタン-1-カルボン酸

1-Methylcyclobutane-1-carboxylic acid

HCID 12757488

基本情報

CAS
32936-76-8
標準SMILES
CC1(C(=O)O)CCC1
InChIKey
GCZGQVRHZLOCDD-UHFFFAOYSA-N
分子式
C6H10O2
平均分子量
114.14 g/mol
単同位体質量
114.06807956

名称と識別子

優先名称
1-Methylcyclobutane-1-carboxylic acid
IUPAC
1-methylcyclobutane-1-carboxylic acid
現地名
1-メチルシクロブタン-1-カルボン酸
英語名
1-Methylcyclobutanecarboxylic acid
分子式
C6H10O2
分子量
114.14

名称と別名

32936-76-81-methylcyclobutane-1-carboxylic acidDTXSID60509084RefChem:232019DTXCID40459891815-101-21-METHYLCYCLOBUTANECARBOXYLIC ACIDMFCD155274941-methyl-cyclobutanecarboxylic acid2-(Nonylthio)propanamideCyclobutanecarboxylic acid, 1-methyl-SCHEMBL264769
名称をさらに表示
1-メチルシクロブタン-1-カルボン酸1-メチルシクロブタンカルボン酸1-methyl-1-cyclobutanecarboxylic acid
1-Methylcyclobutanecarboxylicacid1021343-21-4GCZGQVRHZLOCDD-UHFFFASCHEMBL3153889SCHEMBL20295660GCZGQVRHZLOCDD-UHFFFAOYSA-N1-methylcyclobutane carboxylic acidAKOS006376243

データベース識別子

CAS
32936-76-8
PubChem CID
12757488
DTXSID
DTXSID60509084
EC Number
815-101-2

物性

構造計算による物性

XLogP
1.1
極性表面積
37.3 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
1
重原子数
8

物理化学的性質

沸点
203 ℃ · 203℃
比重(密度)
1.122 · 1.122
闪点
92 ℃ · 92℃
貯蔵温度
Sealed in dry,Room Temperature
酸解離定数(Pka)
5 · 5.00±0.20(Predicted)
外見
liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Dam. 1 (50%);Eye Irrit. 2 (50%);Acute Tox. 4 (100%);STOT SE 3 (100%)

安全データ

ridadr
3265
hs_code
2916200090
hazard_class
8
packing_group
Ⅲ

化学と産業

応用分野

使用1-Methylcyclobutanecarboxylic Acid is used for acid chlorination.

サプライヤー71 社

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
安徽勇晟医药科技有限公司181-3307-5798 18017383231 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

関連反応

3 件

化合物ノート

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