Name: Name:1H-Tetrazole-1-acetic acid, α-(2-furanylmethylene)-5-phenyl-
Brand: Angene
SKU: AG002ATS
Rating: 90 (10 reviews)

1H-Tetrazole-1-acetic acid, α-(2-furanylmethylene)-5-phenyl-

CAS No.:

19747-13-8

Catalog Number:

AG002ATS

Molecular Formula:

C14H10N4O3

Molecular Weight:

282.2542

Catalog Number:

AG002ATS

Chemical Name:

1H-Tetrazole-1-acetic acid, α-(2-furanylmethylene)-5-phenyl-

CAS Number:

19747-13-8

Molecular Formula:

C14H10N4O3

Molecular Weight:

282.2542

MDL Number:

MFCD06357418

IUPAC Name:

3-(furan-2-yl)-2-(5-phenyltetrazol-1-yl)prop-2-enoic acid

InChI:

InChI=1S/C14H10N4O3/c19-14(20)12(9-11-7-4-8-21-11)18-13(15-16-17-18)10-5-2-1-3-6-10/h1-9H,(H,19,20)

InChI Key:

YVQAGBCKIDNFLC-UHFFFAOYSA-N

SMILES:

OC(=O)C(=Cc1ccco1)n1nnnc1c1ccccc1

Complexity:

409

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.259g/mol

Monoisotopic Mass:

282.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1