1-(Benzo[d][1,3]dioxol-5-yl)cyclopropanecarbonitrile

HCID 281502

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Basic information

CAS: 33522-14-4
Standard SMILES: N#CC1(c2ccc3c(c2)OCO3)CC1
InChIKey: VWWFPPDVEFZZCF-UHFFFAOYSA-N
Molecular formula: C11H9NO2
Average molar mass: 187.19 g/mol
Monoisotopic mass: 187.06332853

Names & identifiers

Preferred name: 1-(Benzo[d][1,3]dioxol-5-yl)cyclopropanecarbonitrile
IUPAC: 1-(1,3-benzodioxol-5-yl)cyclopropane-1-carbonitrile
English name: 1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile
Molecular formula: C11H9NO2
Molecular weight: 187.19

Names & synonyms

33522-14-41-(Benzo[d][1,3]dioxol-5-yl)cyclopropanecarbonitrile1-(1,3-benzodioxol-5-yl)cyclopropanecarbonitrileMFCD106928621-(1,3-benzodioxol-5-yl)cyclopropane-1-carbonitrile1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile1-(2H-1,3-benzodioxol-5-yl)cyclopropane-1-carbonitrileNSC134316SCHEMBL6352266DTXSID80300015IBA52214AKOS009264698

Show more names

Cyclopropanecarbonitrile, 1-(1,3-benzodioxol-5-yl)-1-(3,4-Methylenedioxyphenyl)cyclopropanecarbonitrile

NSC-134316AS-41495SY176582DB-068847CS-0088507EN300-421141-(1,3-dioxaindan-5-yl)cyclopropane-1-carbonitrileZ361883130

Database identifiers

CAS: 33522-14-4
PubChem CID: 281502
DTXSID: DTXSID80300015

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 42.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 289

Physicochemical properties

storage temp.: 2 · 2-8°C

Chemistry & industry

Suppliers15 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

上海恩诺生物科技有限公司+86 (21) 6435-5022

苏州启航生物科技有限公司18151111370

赛纳斯特化学（欢迎点击联系）021-60343070

常州合晶化工有限公司85528066 13775048983 · [email protected]

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