4-Cyclopropylnicotinonitrile

CAT: 0127-OR1056923-01Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1056923-01Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

503843-67-2

MDL Number

MFCD11109701

Purity

97%

Smiles

N#CC1=CN=CC=C1C2CC2

Chemical Information

4-Cyclopropylnicotinonitrile

CAS Number	503843-67-2
PubChem CID	45079566
IUPAC Name	4-cyclopropylpyridine-3-carbonitrile
Molecular Formula	C9H8N2
Molecular Weight	144.17
XLogP	1.5
Topological Polar Surface Area	36.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	187

SMILES

C1CC1C2=C(C=NC=C2)C#N

InChI

InChI=1S/C9H8N2/c10-5-8-6-11-4-3-9(8)7-1-2-7/h3-4,6-7H,1-2H2

InChIKey

YAFJSMQTZSFJOG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 503843-67-2

CID: 45079566

Formula: C9H8N2

MW: 144.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	144.17
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	144.068748264
Monoisotopic Mass	144.068748264
Topological Polar Surface Area	36.7 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	187
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1037923-01	6-Chloro-2-cyclopropylnicotinonitrile
OR303703-01	2-Chloro-6-cyclopropylnicotinonitrile
OR303802	2,5-Dichloro-6-cyclopropylnicotinonitrile
OR18050-01	5-Bromo-2-chloro-6-cyclopropylnicotinonitrile
OR1066171-01	3-Cyclopropylpicolinonitrile
PC6412	4,4,4-Trifluorobutyl 4,4,4-trifluorobutanoate
PC5215	4,4,4,4',4',4'-Hexafluorovaline hydrochloride
OR1011275-01	4,4',4'',4'''-Methanetetrayltetraphenol
OR1011273-01	4,4',4'',4'''-Methanetetrayltetrabenzaldehyde
OR1011238-01	4,4,4,4-Silanetetrayltetrabenzaldehyde

Catalog	Name
sc-307478	2-Chloro-6-cyclopropylnicotinonitrile
sc-308871	2,5-Dichloro-6-cyclopropylnicotinonitrile
HY-W099255-01	Ethyl 4,4,4,4',4',4'-hexafluoro-DL-valinate
25725310-100g	4,4'-Sulfonyldiphenol (4,4'-Dihydroxydiphenylsulfone)
FT77427	4,4,4-Trifluorovaline
AAA46134	4,4,4-Trifluorobutanamide
JH290997	4,4,4-Trifluorobutanal
sc-262190B	4,4,4-Trifluorobutyraldehyde
sc-262192A	4,4,4-Trifluorocrotonamide
sc-284451	4,4,4-Trifluorobutylamine