9-(2-Hydroxypropyl)adenine

CAT: 0572-TRC-H952010-1MGSize: 1 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-H952010-1MGSize:1 mg

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CAS Number

14047-26-8

Synonyms

6-Amino-alpha-methyl-9H-purine-9-ethanol; (RS)-9-(2-Hydroxypropyl)adenine; 9-(2-Hydroxyprop-1-yl)adenine; DL-9-(2-Hydroxypropyl)adenine; DL-6-Amino-alpha-methyl-9H-purine-9-ethanol; (±)-DL-6-Amino-alpha-methyl-9H-purine-9-ethanol;

Hazard Statement

No Data Available

Smiles

CC(O)Cn1cnc2c(N)ncnc12

Molecular Formula

C8H11N5O

Molecular Weight

193.21

Shipping Conditions

Room Temperature

Chemical Information

9-(2-Hydroxypropyl)adenine

structure in first source

CAS Number	14047-26-8
PubChem CID	1942
IUPAC Name	1-(6-aminopurin-9-yl)propan-2-ol
Molecular Formula	C8H11N5O
Molecular Weight	193.21
XLogP	-0.4
Topological Polar Surface Area	89.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	202

SMILES

CC(CN1C=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C8H11N5O/c1-5(14)2-13-4-12-6-7(9)10-3-11-8(6)13/h3-5,14H,2H2,1H3,(H2,9,10,11)

InChIKey

MJZYTEBKXLVLMY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14047-26-8

CID: 1942

Formula: C8H11N5O

MW: 193.21

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	193.21
XLogP3	-0.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	193.09635999
Monoisotopic Mass	193.09635999
Topological Polar Surface Area	89.9 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	202
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-W739665-01	9- (2-Hydroxypropyl) adenine-d6
FH10709-01	(R) - (+) -9- (2-Hydroxypropyl) adenine
MBS6029613-01	(R)-9-[2-(Hydroxypropyl] Adenine
sc-219743	(R) -9-[2- (Hydroxypropyl] Adenine
H9111-46D	9-[2- (Hydroxypropyl-d6] Adenine
MBS6117950-01	9-[2-(Hydroxypropyl-d6] Adenine
sc-488251	(S) -9-[2- (Hydroxypropyl] Adenine
166427	S-9-[2- (Hydroxypropyl] Adenine
278736-01	9- (2-Hydroxyethyl) adenine
sc-476675	9- (2-Propenyl) adenine

9-(2-Hydroxypropyl)adenine

Chemical Information

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