3-(1-cyanopropan-2-ylamino)butanenitrile

CAS: 90088-72-5

Molecular Formula	`C8H13N3`
Molecular Weight	151.21 g/mol
Topological Polar Surface Area	59.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	151.11095
Heavy Atoms	11
Complexity	170.0

Chemical Identifiers

CAS Number	90088-72-5
SMILES	`CC(CC#N)NC(C)CC#N`
InChIKey	`XCZJUCJIQIXSBZ-UHFFFAOYSA-N`

📖 Product Overview

3-(1-cyanopropan-2-ylamino)butanenitrile (CAS: 90088-72-5) is a chemical compound with molecular formula C8H13N3 and molecular weight 151.21 g/mol. Its IUPAC systematic name is 3-(1-cyanopropan-2-ylamino)butanenitrile. Topological Polar Surface Area 59.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 151.11095 Heavy Atoms 11 Complexity 170.0 InChI Key: XCZJUCJIQIXSBZ-UHFFFAOYSA-N. SMILES: CC(CC#N)NC(C)CC#N.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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