Name: Name:9H-Purine-9-acetic acid, 6-amino-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG007YK1
Rating: 90 (10 reviews)

9H-Purine-9-acetic acid, 6-amino-, 1,1-dimethylethyl ester

CAS No.:

152774-16-8

Catalog Number:

AG007YK1

Molecular Formula:

C11H15N5O2

Molecular Weight:

249.2691

Catalog Number:

AG007YK1

Chemical Name:

9H-Purine-9-acetic acid, 6-amino-, 1,1-dimethylethyl ester

CAS Number:

152774-16-8

Molecular Formula:

C11H15N5O2

Molecular Weight:

249.2691

MDL Number:

MFCD28975264

IUPAC Name:

tert-butyl 2-(6-aminopurin-9-yl)acetate

InChI:

InChI=1S/C11H15N5O2/c1-11(2,3)18-7(17)4-16-6-15-8-9(12)13-5-14-10(8)16/h5-6H,4H2,1-3H3,(H2,12,13,14)

InChI Key:

DLXYCJXQTOWEKX-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)Cn1cnc2c1ncnc2N

Complexity:

317

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.123g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.274g/mol

Monoisotopic Mass:

249.123g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9