Basic information
- CAS
7306-67-4- Standard SMILES
Nc1ncnc2c1ncn2C1CCCCO1- InChIKey
ATNWAGKQIUHFQP-UHFFFAOYSA-N- Molecular formula
- C10H13N5O
- Average molar mass
- 219.24 g/mol
- Monoisotopic mass
- 219.11201006
Overview
See also: 9-(2-Tetrahydropyranyl)adenine (annotation moved to).
Names & identifiers
- Preferred name
- 9-(Tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine
- IUPAC
- 9-(oxan-2-yl)purin-6-amine
- English name
- 9-(oxan-2-yl)purin-6-amine
- Molecular formula
- C10H13N5O
- Molecular weight
- 219.24
Names & synonyms
9-(tetrahydro-2h-pyran-2-yl)-9h-purin-6-amineDTXSID40274344RefChem:1074917DTXCID702258247306-67-49-(oxan-2-yl)purin-6-amine6-Amino-9-(tetrahydropyran-2-yl)-9H-purineMFCD002133339-(oxan-2-yl)-9H-purin-6-amine6-Amino-9-tetrahydropyranylpurine6-AMINO-9-TETRAHYDROPYRANAL PURINENSC38728
Show more names
9H-Purin-6-amine, 9-(tetrahydro-2H-pyran-2-yl)-
9-(Tetrahydro-pyran-2-yl)-9H-purin-6-ylaMineOprea1_1460229-N-Tetrahydropyranyl-adenineSCHEMBL675830SCHEMBL2876046SCHEMBL30988430NSC-38728AKOS016011923
Database identifiers
- CAS
7306-67-4- PubChem CID
- 1932
- DTXSID
DTXSID40274344- Nikkaji
- J276.895J
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Melting point
- 187 · 187-189 °C
- Boiling point
- 477.7 · 477.7±55.0 °C(Predicted)
- Density
- 1.6 · 1.60±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 3.86 · 3.86±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers28 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海忆嵘生物科技有限公司18049974220 · [email protected]
上海先诺生物科技有限公司021-50718719 13918719472
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
湖州清硫硅生物科技有限公司13626726938 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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