POLY(ACRYLONITRILE-CO-BUTADIENE-CO-STYRENE)

General Information

MaintermPOLY(ACRYLONITRILE-CO-BUTADIENE-CO-STYRENE)
CAS Reg.No.(or other ID)9003-56-9
Regnum 175.105
175.300
175.320
176.180
177.1010
177.1200
177.1020
175.125
181.32

From www.fda.gov

Computed Descriptors

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2D Structure
CID24756
IUPAC Namebuta-1,3-diene;prop-2-enenitrile;styrene
InChIInChI=1S/C8H8.C4H6.C3H3N/c1-2-8-6-4-3-5-7-8;1-3-4-2;1-2-3-4/h2-7H,1H2;3-4H,1-2H2;2H,1H2
InChI KeyXECAHXYUAAWDEL-UHFFFAOYSA-N
Canonical SMILESC=CC=C.C=CC#N.C=CC1=CC=CC=C1
Molecular FormulaC15H17N
WikipediaAcrylonitrile butadiene styrene

From Pubchem

Computed Properties

Property Name Property Value
Molecular Weight211.308
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Complexity144.0
CACTVS Substructure Key Fingerprint A A A D c e B y A A A A A A A A A A A A A A A A A A A A A A A A A A A w A A A A A A A A A A A B A A A A H A A A A A A A D A C B G A A w A I A A A A C Q B i B C A A A i A A A g A A A I i A A A A I g I I C K A E R C A I A A g g A A I i A c A g A A O A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = =
Topological Polar Surface Area23.8
Monoisotopic Mass211.136
Exact Mass211.136
Compound Is CanonicalizedTrue
Formal Charge0
Heavy Atom Count16
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Isotope Atom Count0
Covalently-Bonded Unit Count3

From Pubchem

Taxonomic Classification

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassStyrenes
Intermediate Tree NodesNot available
Direct ParentStyrenes
Alternative Parents
Molecular FrameworkNot available
SubstituentsStyrene - Aromatic hydrocarbon - Cyclic olefin - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as styrenes. These are organic compounds containing an ethenylbenzene moiety.

From ClassyFire