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634-01-5

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Basic Information
CAS No.: 634-01-5
Name: ADENOSINE-2',3'-CYCLIC PHOSPHATE
Article Data: 47
Molecular Structure:
Molecular Structure of 634-01-5 (ADENOSINE-2',3'-CYCLIC PHOSPHATE)
Formula: C10H12N5O6P
Molecular Weight: 329.209
Synonyms: 2',3'-Cyclic AMP;(2R,3aR,4R,6R,6aR)-4-(6-Amino-9H-purin-9-yl)-6-(hydroxymethyl)tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide;Adenosine 2',3'-(hydrogen phosphate);AC1L2RLB;Tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide;AC1Q6TG0;[(3aR,4R,6R,6aR)-4-(6-Aminopurin-9-yl)-2-hydroxy-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-6-yl]methanol;
EINECS: 211-202-5
Density: 2.47 g/cm3
Melting Point: 208-213°C
Boiling Point: 688.2 °C at 760 mmHg
Flash Point: 370 °C
PSA: 164.65000
LogP: -0.23620
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Specification

The Adenosine, cyclic2',3'-(hydrogen phosphate) with CAS registry number of 634-01-5 is also known as 2',3'-Cyclic AMP. The IUPAC name is [(3aR,4R,6R,6aR)-4-(6-Aminopurin-9-yl)-2-hydroxy-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-6-yl]methanol. It belongs to product categories of Nucleic Acids; Bases & Related Reagents; Nucleotides. Its EINECS registry number is 211-202-5. In addition, the formula is C10H12N5O6P and the molecular weight is 329.21.

Physical properties about Adenosine, cyclic2',3'-(hydrogen phosphate) are: (1)#H bond acceptors: 11; (2)#H bond donors: 4; (3)#Freely Rotating Bonds: 3; (4)Index of Refraction: 2.011; (5)Molar Refractivity: 67.04 cm3; (6)Molar Volume: 133 cm3; (7)Surface Tension: 153.8 dyne/cm; (8)Density: 2.47 g/cm3; (9)Flash Point: 370 °C; (10)Enthalpy of Vaporization: 105.96 kJ/mol; (11)Boiling Point: 688.2 °C at 760 mmHg; (12)Vapour Pressure: 6.91E-20 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=NC2=C(C(=N1)N)N=CN2C3C4C(C(O3)CO)OP(=O)(O4)O
2. Isomeric SMILES: C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@H]4[C@@H]([C@H](O3)CO)OP(=O)(O4)O
3. InChI: InChI=1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7-6(4(1-16)19-10)20-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
4. InChIKey: KMYWVDDIPVNLME-KQYNXXCUSA-N