Cas no 2972-83-0 (Propanedinitrile,2-(1-naphthalenylmethylene)-)
2972-83-0 structure
Product Name:Propanedinitrile,2-(1-naphthalenylmethylene)-
Propanedinitrile,2-(1-naphthalenylmethylene)- Chemical and Physical Properties
Names and Identifiers
-
- Propanedinitrile,2-(1-naphthalenylmethylene)-
- 2-(naphthalen-1-ylmethylidene)propanedinitrile
- (1-Naphthylmethylene)malononitrile
- (1-naphthylmethylidene)malononitrile
- [1]naphthylmethylene-malononitrile
- 1-naphthylmethylidenemalononitrile
- 2-(naphthalen-1-ylmethylene)malononitrile
- AC1L2BBT
- BRN 1949584
- MALONONITRILE, (1-NAPHTHYLMETHYLENE)-
- naphthalene deriv. 22
- NSC61945
- AKOS002951302
- 1,1-Dicyano-2-(1-naphthyl)ethylene
- CBMicro_016319
- SCHEMBL4820296
- CHEMBL66074
- HNVAUTUJXUMGPH-UHFFFAOYSA-N
- DTXSID10183873
- NSC 61945
- NSC-61945
- BDBM5188
- 2-(1-Naphthalenylmethylene)propanedinitrile
- Propanedinitrile, 2-(1-naphthalenylmethylene)-
- 3-09-00-04523 (Beilstein Handbook Reference)
- 2-[(naphthalen-1-yl)methylidene]propanedinitrile
- BIM-0016171.P001
- X3RBT3WY4W
- (1-naphthalenylmethylene)-propanedinitrile
- 2972-83-0
- CCG-5316
-
- Inchi： 1S/C14H8N2/c15-9-11(10-16)8-13-6-3-5-12-4-1-2-7-14(12)13/h1-8H
- InChI Key： HNVAUTUJXUMGPH-UHFFFAOYSA-N
- SMILES： N#C/C(/C#N)=C/C1C=CC=C2C=CC=CC2=1
Computed Properties
- Exact Mass: 204.06884
- Monoisotopic Mass: 204.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 358
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 47.6?2
Experimental Properties
- PSA: 47.58
Propanedinitrile,2-(1-naphthalenylmethylene)- Related Literature
-
Xianghua Yang,Thomas Fox,Heinz Berke Org. Biomol. Chem. 2012 10 852
-
Sumit Kumar Panja,Nidhi Dwivedi,Satyen Saha RSC Adv. 2015 5 65526
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