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结构：COC(=O)C1CC=CCC1C(=O)OC
HCID24124

4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester

dimethyl cyclohex-4-ene-1,2-dicarboxylate

C10H14O4198.22 g/molCAS 7500-55-2
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IDENTITY

结构与身份

标准 SMILES
COC(=O)C1CC=CCC1C(=O)OC
InChIKey
DVVAGRMJGUQHLI-UHFFFAOYSA-N
分子式
C10H14O4
平均分子量
198.22 g/mol
单同位素质量
198.08920892

COMPUTED

结构计算性质

已同步
XLogP
1.1
极性表面积
52.6 Ų
氢键供体
0
氢键受体
4
可旋转键
4
重原子
14
形式电荷
0
复杂度
231

PROPERTIES

实验与物化性质

来源：PubChem
Kovats Retention Index

1359；1365；1373；1381

GHS

GHS 分类

来源：PubChem
GHS Classification

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 39 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.

HAZARDS

危害信息

来源：PubChem
Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

USES

用途与制造

来源：PubChem
General Manufacturing Information

4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester: INACTIVE

ALIASES

名称与别名

共 34 条
Dimethyl 4-cyclohexene-1,2-dicarboxylate7500-55-24-CYCLOHEXENE-1,2-DICARBOXYLIC ACID, DIMETHYL ESTERNSC 401683BRN 1876401AI3-034084-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl esterDTXSID50884392RefChem:522301DTXCID801000932633-295-5dimethyl cyclohex-4-ene-1,2-dicarboxylateRP 1 (ester)RP 1Dimethyl trans-cyclohex-4-ene-1,2-dioatestarbld0018115cis-4-Cyclohexene-1,2-dicarboxylic Acid Dimethyl EsterNCIOpen2_000700SCHEMBL4180704-Cyclohexene-1, dimethyl ester

REACTIONS

参与反应

2 条
全部作为反应物作为生成物作为试剂作为催化剂作为溶剂