Name: Name:5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1h-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG00H9A9
Rating: 90 (10 reviews)

5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1h-pyrazole-4-carbaldehyde

CAS No.:

1006482-46-7

Catalog Number:

AG00H9A9

Molecular Formula:

C12H10N2O3

Molecular Weight:

230.2194

Catalog Number:

AG00H9A9

Chemical Name:

5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1h-pyrazole-4-carbaldehyde

CAS Number:

1006482-46-7

Molecular Formula:

C12H10N2O3

Molecular Weight:

230.2194

MDL Number:

MFCD08444451

IUPAC Name:

5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carbaldehyde

InChI:

InChI=1S/C12H10N2O3/c15-7-9-6-13-14-12(9)8-1-2-10-11(5-8)17-4-3-16-10/h1-2,5-7H,3-4H2,(H,13,14)

InChI Key:

WHHUOCWLINQUEL-UHFFFAOYSA-N

SMILES:

O=Cc1cn[nH]c1c1ccc2c(c1)OCCO2

Complexity:

287

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.223g/mol

Monoisotopic Mass:

230.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1