メタクリル酸4-ヒドロキシブチル

4-Hydroxybutyl methacrylate

HCID 70457CAS 997-46-6

基本情報

標準SMILES
C=C(C)C(=O)OCCCCO
InChIKey
YKXAYLPDMSGWEV-UHFFFAOYSA-N
分子式
C8H14O3
平均分子量
158.19 g/mol
単同位体質量
158.0942943

名称と識別子

優先名称
4-Hydroxybutyl methacrylate
IUPAC
4-hydroxybutyl 2-methylprop-2-enoate
現地名
メタクリル酸4-ヒドロキシブチル
英語名
4-Hydroxybutyl methacrylate
分子式
C8H14O3
分子量
158.2

名称と別名

4-Hydroxybutyl methacrylate997-46-6EINECS 213-642-3DTXSID30244213RefChem:99295DTXCID30166704213-642-34-hydroxybutyl 2-methylprop-2-enoate29008-35-3Methacrylic acid, monoester with 1,2-butanediolstarbld00087044KBH8DN4TL
名称をさらに表示
メタクリル酸4-ヒドロキシブチルHYDROXYBUTYL METHACRYLATE1,4-BUTANEDIOLMETHACRYLATE4-methacryloyloxybutyl alcohol2-Propenoic acid, 2-methyl-, 4-hydroxybutyl ester
4-methacryloyloxybutan-1-olSCHEMBL14872SCHEMBL812435SCHEMBL11412289SCHEMBL17437694AKOS025296078AS-86599NS00043075

データベース識別子

CAS
997-46-6
PubChem CID
70457
DTXSID
DTXSID30244213
UNII
4KBH8DN4TL
EC Number
213-642-3
Nikkaji
J25.107K

物性

構造計算による物性

XLogP
1.7
極性表面積
46.5 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
6
重原子数
11

物理化学的性質

沸点
65 · 65-70 °C(Press: 0.05 Torr)
比重(密度)
1.01 · 1.010±0.06 g/cm3(Predicted)
酸解離定数(Pka)
14.98 · 14.98±0.10(Predicted)

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal];H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin];H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P261, P264, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P333+P317, P362+P364, 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.;Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.;There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).;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

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesAcute Tox. 4 (50%);Acute Tox. 4 (50%);Skin Sens. 1 (50%);Acute Tox. 4 (50%)

法規制情報

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

安全データ

tsca
TSCA listed

化学と産業

用途と製造

General Manufacturing Information2-Propenoic acid, 2-methyl-, 4-hydroxybutyl ester: ACTIVE

サプライヤー15 社

湖南嘉航医药科技有限公司85521272 15200744171 · [email protected]
杭州辅润医药科技有限公司15658004993 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
杭州六可生物科技有限公司+86-0571-86912261 +86-15658003402 · [email protected]

関連反応

6 件

関連ノート

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