Basic information
- CAS
32730-85-1- Standard SMILES
N#CC1CCCCCC1- InChIKey
UIZRDFICGGONJJ-UHFFFAOYSA-N- Molecular formula
- C8H13N
- Average molar mass
- 123.2 g/mol
- Monoisotopic mass
- 123.10479942
Names & identifiers
- Preferred name
- Cycloheptanecarbonitrile
- IUPAC
- cycloheptanecarbonitrile
- English name
- CYCLOHEPTYL CYANIDE
- Molecular formula
- C8H13N
- Molecular weight
- 123.2
Names & synonyms
Cycloheptanecarbonitrile32730-85-1Cycloheptyl cyanideEINECS 251-180-4AI3-33238DTXSID50186404NSC 84183RefChem:129505DTXCID20108895251-180-4UIZRDFICGGONJJ-UHFFFAOYSA-NMFCD00004148
Show more names
CYANOCYCLOHEPTANETIMTEC-BB SBB008917Cycloheptane-1-carbonitrile
NSC84183cycloheptankohlenitrileCycloheptyl cyanide, 97%SCHEMBL59959SCHEMBL2533242SCHEMBL2538718SCHEMBL2539223SCHEMBL8075516
Database identifiers
- CAS
32730-85-1- PubChem CID
- 96653
- DTXSID
DTXSID50186404- EC Number
- 251-180-4
- Nikkaji
- J275.840G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 112
Physicochemical properties
- Boiling point
- 85 · 85-86 °C10 mm Hg(lit.)
- Density
- 0.925 g/mL · 0.925 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.464(lit.)
- Flash point
- 185 °F · 185 °F
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- Colorless to light yellow Liquid
- Exposure limits
- 25 mg/m3 · NIOSH: IDLH 25 mg/m3
- CAS DataBase Reference
- 32730 · 32730-85-1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
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
Warning
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]；H319 (100%): 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, 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 44 reports by companies from 4 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)
Safety data
- wgk
- 3
- ridadr
- UN3276
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers17 total
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Syntechem Co.,Ltd[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
重庆科脉材料科技有限公司17830741407 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
Related reactions
6 records
Compound notes
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