Cas no 5443-89-0 (9H-Purine,6-(pentylthio)-)
9H-Purine,6-(pentylthio)- structure
Product Name:9H-Purine,6-(pentylthio)-
CAS No:5443-89-0
MF:C10H14N4S
MW:222.309959888458
CID:373537
PubChem ID:79515
Update Time:2025-04-19
9H-Purine,6-(pentylthio)- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Purine,6-(pentylthio)-
- 6-(pentylthio)-1H-purine
- 6-pentylsulfanyl-7H-purine
- 6-Amylmercaptopurine
- 6-n-Amylmercaptopurine
- EINECS 226-638-1
- HMS1650G09
- 6-(Pentylsulfanyl)-9H-purine #
- 1H-Purine, 6-(pentylthio)-
- AKOS002326873
- SR-01000007365
- NSC19864
- Purine, 6-Pentylthio
- Q27116087
- 1H-PURINE,6-(PENTYLTHIO)-
- 6-(Pentylthio)purine
- AB00172555-03
- CHEBI:34465
- Purine, 6-(pentylthio)-
- NS00033083
- UDXMVJZRHSMPEJ-UHFFFAOYSA-N
- 6-(pentylthio)-9H-purine
- NSC-19864
- 5443-89-0
- BDBM50371878
- 9H-PURINE, 6-(PENTYLTHIO)-
- CHEMBL259041
- 6-Amyl-mp
- DTXSID10202831
- Purine, 6-pentylthio-
- 6-Pentylsulfanyl-9H-purine
- SCHEMBL1725582
- NSC 19864
- 380934R16P
- SR-01000007365-1
- UNII-380934R16P
-
- Inchi： 1S/C10H14N4S/c1-2-3-4-5-15-10-8-9(12-6-11-8)13-7-14-10/h6-7H,2-5H2,1H3,(H,11,12,13,14)
- InChI Key： UDXMVJZRHSMPEJ-UHFFFAOYSA-N
- SMILES： S(C1=C2C(=NC=N1)N=CN2)CCCCC
Computed Properties
- Exact Mass: 222.09400
- Monoisotopic Mass: 222.09391764g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 190
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 79.8?2
Experimental Properties
- PSA: 79.76000
- LogP: 2.63520
9H-Purine,6-(pentylthio)- Customs Data
- HS CODE：2933990090
- Customs Data：
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
9H-Purine,6-(pentylthio)- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
5443-89-0 (9H-Purine,6-(pentylthio)-) Related Products
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