Structure

5-Norbornene-2-carbonitrile

CAS
95-11-4
Catalog Number
ACM95114
Category
Polymer/Macromolecule
Molecular Weight
119.16g/mol
Molecular Formula
C8H9N

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Specification

Synonyms
TIMTEC-BB SBB007934;5-Cyanobicyclo[2.2.1]hept-2-ene;BICYCLO[2.2.1]HEPT-5-ENE-2-CARBONITRILE;BICYCLO[2.2.1]-5-HEPTENE-2-CARBONITRILE;5-NORBORNENE-2-CARBONITRILE;5-NORBORNENE-2-CARBONITRILE, 98%, MIXTUR E OF ISOMERS;5-norbornene-2-carbonitrile, mixture of i
IUPAC Name
bicyclo[2.2.1]hept-5-ene-2-carbonitrile
Canonical SMILES
C1C2CC(C1C=C2)C#N
InChI
InChI=1S/C8H9N/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-4H2
InChI Key
BMAXQTDMWYDIJX-UHFFFAOYSA-N
Complexity
196
Covalently-Bonded Unit Count
1
EC Number
202-391-5
Exact Mass
119.073499g/mol
Formal Charge
0
H-Bond Acceptor
1
H-Bond Donor
0
Heavy Atom Count
9
Monoisotopic Mass
119.073499g/mol
NSC Number
147246
Rotatable Bond Count
0
XLogP3
1.4
What is the molecular formula of 5-Norbornene-2-carbonitrile?

The molecular formula of 5-Norbornene-2-carbonitrile is C8H9N.

What is the molecular weight of 5-Norbornene-2-carbonitrile?

The molecular weight of 5-Norbornene-2-carbonitrile is 119.16 g/mol.

What is the IUPAC name of 5-Norbornene-2-carbonitrile?

The IUPAC name of 5-Norbornene-2-carbonitrile is bicyclo[2.2.1]hept-5-ene-2-carbonitrile.

How many hydrogen bond acceptors does 5-Norbornene-2-carbonitrile have?

5-Norbornene-2-carbonitrile has 1 hydrogen bond acceptor.

What is the XLogP3-AA value of 5-Norbornene-2-carbonitrile?

The XLogP3-AA value of 5-Norbornene-2-carbonitrile is 1.4.

What is the InChIKey of 5-Norbornene-2-carbonitrile?

The InChIKey of 5-Norbornene-2-carbonitrile is BMAXQTDMWYDIJX-UHFFFAOYSA-N.

How many heavy atoms does 5-Norbornene-2-carbonitrile contain?

5-Norbornene-2-carbonitrile contains 9 heavy atoms.

What is the topological polar surface area of 5-Norbornene-2-carbonitrile?

The topological polar surface area of 5-Norbornene-2-carbonitrile is 23.8 Ų.

Does 5-Norbornene-2-carbonitrile have any defined atom stereocenters?

No, 5-Norbornene-2-carbonitrile does not have any defined atom stereocenters.

What is the CAS number for 5-Norbornene-2-carbonitrile?

The CAS number for 5-Norbornene-2-carbonitrile is 95-11-4.

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