HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2,2-Diphenylcyclopropanecarbonitrile

HCID 98397
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
30932-41-3
Standard SMILES
N#CC1CC1(c1ccccc1)c1ccccc1
InChIKey
DHLFXGMJDRNWME-UHFFFAOYSA-N
Molecular formula
C16H13N
Average molar mass
219.28 g/mol
Monoisotopic mass
219.10479942

Names & identifiers

Preferred name
2,2-Diphenylcyclopropanecarbonitrile
IUPAC
2,2-diphenylcyclopropane-1-carbonitrile
English name
2,2-diphenylcyclopropanecarbonitrile
Molecular formula
C16H13N
Molecular weight
219.28

Names & synonyms

2,2-Diphenylcyclopropanecarbonitrile30932-41-3EINECS 250-397-1NSC 120433RefChem:81118250-397-12,2-diphenylcyclopropane-1-carbonitrileCyclopropanecarbonitrile, 2,2-diphenyl-MFCD00182382NSC120433SCHEMBL95431152,2-Diphenylcyclopropane carbonitrile
Show more names
2,2-diphenylcyclopropylnitrile2,2-Diphenylcyclopropyl cyanide1-Cyano-2,2-diphenylcyclopropane
DTXSID801292080TD8144AKOS015998965CS-W013152NSC-120433DS-18486SY066598DB-068386

Database identifiers

CAS
30932-41-3
PubChem CID
98397
DTXSID
DTXSID801292080
EC Number
250-397-1
Nikkaji
J287.413J

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
23.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
294

Physicochemical properties

Melting point
108 · 108-110℃
Boiling point
374.9 · 374.9±42.0 °C(Predicted)
Density
1.14 · 1.14
storage temp.
Sealed in dry,Room Temperature
solubility
Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form
Solid
color
White
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
264 · P264-P270-P301+P312-P330-P501
Safety Statements
24 · 24/25
HS Code
29269090 · 29269090
REACH Registrations
Active

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationREACH registered substance: 2,2-diphenylcyclopropanecarbonitrile (EC: 250-397-1)
Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code
29269090
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
24/25
Hazard statements
H302
REACH Registrations
Active
Precautionary statements
P264-P270-P301+P312-P330-P501

Chemistry & industry

Applications

Uses2,2-Diphenylcyclopropanecarbonitrile is used in the synthetic preparation of cyclopropanation or metathesis products by reactions of diazo compds. with alkenes catalyzed by [RuCl(cod)(Cp)].

Suppliers49 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
南京哈柏医药科技有限公司13376080562 13376090521 · [email protected]

Related reactions

3 records
New reaction record
HRID 819730 reaction equation
HRID 819730As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1651111 reaction equation
HRID 1651111As reactantuspto-grants-1990_05
HRID 2232149 reaction equation
HRID 2232149As reactantuspto-grants-1988_11

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Aceschem Inc.+1-817863-6948 +1-(817)863-6948 · [email protected]
南京唯博特医药科技有限公司18066048793 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
南京恩德萨生物科技有限公司025-58862853 18915922038 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
郑州阿尔法化工有限公司0371-53765687 18937137882 · [email protected]
石家庄默一化工科技有限公司0311-85511132 18031831025 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
上海裕梅医药科技有限公司13661490451 13671802554 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
广东翁江化学试剂有限公司0751-2815688 13927872512 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
天津合信成赛科科技发展有限公司022-23410962 13752273685 · [email protected]
Changzhou Ansciep Chemical Co., Ltd.+86 519 86305871 · [email protected]
浙江联硕生物科技有限公司18616526224 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海亿万化工有限公司00-18662433356 18662433356 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]