Name: Name:2-[5-(morpholin-4-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]acetonitrile hydrobromide
Brand: Angene
SKU: AG019UMW
Rating: 90 (10 reviews)

2-[5-(morpholin-4-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]acetonitrile hydrobromide

CAS No.:

1171589-44-8

Catalog Number:

AG019UMW

Molecular Formula:

C11H16BrN5O

Molecular Weight:

314.1816

Catalog Number:

AG019UMW

Chemical Name:

2-[5-(morpholin-4-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]acetonitrile hydrobromide

CAS Number:

1171589-44-8

Molecular Formula:

C11H16BrN5O

Molecular Weight:

314.1816

MDL Number:

MFCD11857872

IUPAC Name:

2-(5-morpholin-4-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)acetonitrile;hydrobromide

InChI:

InChI=1S/C11H15N5O.BrH/c1-2-5-16-10(3-4-12)13-14-11(16)15-6-8-17-9-7-15;/h2H,1,3,5-9H2;1H

InChI Key:

WKHGAVBISJFCPK-UHFFFAOYSA-N

SMILES:

C=CCn1c(nnc1CC#N)N1CCOCC1.Br

Complexity:

306

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

313.054g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

314.187g/mol

Monoisotopic Mass:

313.054g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: