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2-Cl-Ade

CAT: 1106-BLG-C040-50Size: 5x 10 μmoLDry Ice: NoHazardous: No
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CAT#:1106-BLG-C040-50Size:5x 10 μmoL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1839-18-5
Product Name Alternative
2-Chloroadenine
Certification
RUO
Type
Modified nucleotides
Purity
> 95% HPLC
Molecular Formula
C 5 H 4 ClN 5
Molecular Weight
169.6
Shipping Conditions
Ambient Temperature
Storage Conditions
-20°C
Notes
For the Original Manufacturer’s data sheet please click here .

Chemical Information

2-Chloroadenine
CAS Number1839-18-5
PubChem CID94904
IUPAC Name2-chloro-7H-purin-6-amine
Molecular FormulaC5H4ClN5
Molecular Weight169.57
XLogP0.4
Topological Polar Surface Area80.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity154
SMILES
C1=NC2=NC(=NC(=C2N1)N)Cl
InChI
InChI=1S/C5H4ClN5/c6-5-10-3(7)2-4(11-5)9-1-8-2/h1H,(H3,7,8,9,10,11)
InChIKey
HBJGQJWNMZDFKL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Chloroadenine
CAS: 1839-18-5
CID: 94904
Formula: C5H4ClN5
MW: 169.57
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight169.57
XLogP30.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass169.0155228
Monoisotopic Mass169.0155228
Topological Polar Surface Area80.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity154
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes