Name: Name:3-Isoxazolecarboxylic acid, 5-(1-methyl-1H-pyrrol-2-yl)-, methyl ester
Brand: Angene
SKU: AG0013F5
Rating: 90 (10 reviews)

3-Isoxazolecarboxylic acid, 5-(1-methyl-1H-pyrrol-2-yl)-, methyl ester

CAS No.:

1375064-53-1

Catalog Number:

AG0013F5

Molecular Formula:

C10H10N2O3

Molecular Weight:

206.1980

Catalog Number:

AG0013F5

Chemical Name:

3-Isoxazolecarboxylic acid, 5-(1-methyl-1H-pyrrol-2-yl)-, methyl ester

CAS Number:

1375064-53-1

Molecular Formula:

C10H10N2O3

Molecular Weight:

206.1980

MDL Number:

MFCD22192341

IUPAC Name:

methyl 5-(1-methylpyrrol-2-yl)-1,2-oxazole-3-carboxylate

InChI:

InChI=1S/C10H10N2O3/c1-12-5-3-4-8(12)9-6-7(11-15-9)10(13)14-2/h3-6H,1-2H3

InChI Key:

QOTQMCIMLRRIDB-UHFFFAOYSA-N

SMILES:

COC(=O)c1noc(c1)c1cccn1C

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

206.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

206.201g/mol

Monoisotopic Mass:

206.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: