Name: Name:8-Bromo-7-(but-2-yn-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione
Brand: Angene
SKU: AG0036ZB
Rating: 90 (10 reviews)

8-Bromo-7-(but-2-yn-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione

CAS No.:

666816-98-4

Catalog Number:

AG0036ZB

Molecular Formula:

C10H9BrN4O2

Molecular Weight:

297.1081

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

25mg

In Stock USA

United States

$87

- +

100mg

In Stock USA

United States

$225

- +

Catalog Number:

AG0036ZB

Chemical Name:

8-Bromo-7-(but-2-yn-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione

CAS Number:

666816-98-4

Molecular Formula:

C10H9BrN4O2

Molecular Weight:

297.1081

MDL Number:

MFCD22126091

IUPAC Name:

8-bromo-7-but-2-ynyl-3-methylpurine-2,6-dione

InChI:

InChI=1S/C10H9BrN4O2/c1-3-4-5-15-6-7(12-9(15)11)14(2)10(17)13-8(6)16/h5H2,1-2H3,(H,13,16,17)

InChI Key:

HFZOBQSHTNNKFY-UHFFFAOYSA-N

SMILES:

CC#CCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

EC Number:

613-975-8

Complexity:

427

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

295.991g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

297.112g/mol

Monoisotopic Mass:

295.991g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1