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N-(1-cyanocyclohexyl)benzamide

HCID 569482
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
92255-24-8
Standard SMILES
N#CC1(NC(=O)c2ccccc2)CCCCC1
InChIKey
CFCBDGZNNIYDQX-UHFFFAOYSA-N
Molecular formula
C14H16N2O
Average molar mass
228.29 g/mol
Monoisotopic mass
228.12626314

Names & identifiers

Preferred name
N-(1-cyanocyclohexyl)benzamide
IUPAC
N-(1-cyanocyclohexyl)benzamide
English name
N-(1-Cyano-cyclohexyl)-benzamide
Molecular formula
C14H16N2O
Molecular weight
228.29

Names & synonyms

N-(1-Cyanocyclohexyl)benzamide92255-24-8RefChem:823564986-155-3MFCD112264131-Benzoylamino-1-cyanocyclohexaneN-(1-Cyano-cyclohexyl)-benzamideCFCBDGZNNIYDQX-UHFFFAOYSA-NN-(1-Cyanocyclohexyl)benzamide #SDA25524AKOS005256428EN300-76505
Show more names
Benzamide, N-(1-cyanocyclohexyl)-
G45386Z86908908

Database identifiers

CAS
92255-24-8
PubChem CID
569482
EC Number
986-155-3

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
52.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
316

Physicochemical properties

Melting point
136 · 136-137 °C
Boiling point
470.6 · 470.6±28.0 °C(Predicted)
Density
1.13 · 1.13±0.1 g/cm3(Predicted)
pka
11.76 · 11.76±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

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]

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers1 total

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

Related reactions

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Compound notes

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