Name: Name:ethyl 5-(chloromethyl)-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxylate
Brand: Angene
SKU: AG019UEF
Rating: 90 (10 reviews)

ethyl 5-(chloromethyl)-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxylate

CAS No.:

1118787-44-2

Catalog Number:

AG019UEF

Molecular Formula:

C10H10ClN3O3

Molecular Weight:

255.6577

Catalog Number:

AG019UEF

Chemical Name:

ethyl 5-(chloromethyl)-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxylate

CAS Number:

1118787-44-2

Molecular Formula:

C10H10ClN3O3

Molecular Weight:

255.6577

MDL Number:

MFCD11839858

IUPAC Name:

ethyl 5-(chloromethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

InChI:

InChI=1S/C10H10ClN3O3/c1-2-17-10(16)7-5-12-14-8(15)3-6(4-11)13-9(7)14/h3,5,12H,2,4H2,1H3

InChI Key:

IZARJLQSTCNZEO-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnn2c1nc(CCl)cc2O

Complexity:

467

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.658g/mol

Monoisotopic Mass:

255.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5