Basic information
- CAS
68724-11-8- Standard SMILES
Cc1cn(COCCO)c(=O)[nH]c1=O- InChIKey
ATKOZYBRBNGECU-UHFFFAOYSA-N- Molecular formula
- C8H12N2O4
- Average molar mass
- 200.19 g/mol
- Monoisotopic mass
- 200.07970686
Overview
structure given in first source
Names & identifiers
- Preferred name
- N-(2-(Hydroxyethoxy)methyl)-5-methyluracil
- IUPAC
- 1-(2-hydroxyethoxymethyl)-5-methylpyrimidine-2,4-dione
- English name
- 1-(2-HYDROXYETHOXY)METHYL-5-METHYLURACIL
- Molecular formula
- C8H12N2O4
- Molecular weight
- 200.19
Names & synonyms
68724-11-8AcyclothymidineN-(2-(Hydroxyethoxy)methyl)-5-methyluracilDTXSID40218849RefChem:161619DTXCID401413401-(2-HYDROXYETHOXY)METHYL-5-METHYLURACIL1-((2-hydroxyethoxy)methyl)-5-methylpyrimidine-2,4(1H,3H)-dione1-(2-hydroxyethoxymethyl)-5-methylpyrimidine-2,4-dione1-[(2-hydroxyethoxy)methyl]-5-methylpyrimidine-2,4(1h,3h)-dione1-[(2-Hydroxyethoxy)methyl]thymine1-(2-hydroxyethoxymethyl)-5-methyl-pyrimidine-2,4-dione
Show more names
5-Methyl-1-[(2-hydroxyethoxy)methyl]uracil5-benzamido-2-sulfobenzenediazonium chloride2,4(1H,3H)-Pyrimidinedione, 1-[(2-hydroxyethoxy)me1-(2-HYDROXYETHOXY)METHYL-5-METHYLURACIL ISO 9001:2015 REACH2,4(1H,3H)-Pyrimidinedione, 1-[(2-hydroxyethoxy)methyl]-5-methyl-
1-[(2-OHEtO)Me]TCHEMBL11762SCHEMBL4088248ATKOZYBRBNGECU-UHFFFAOYSA-NHMS1617P15AKOS001696902CCG-117022SB59420
Database identifiers
- CAS
68724-11-8- PubChem CID
- 72358
- DTXSID
DTXSID40218849- ChEMBL
CHEMBL11762- Nikkaji
- J33.402B
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Melting point
- 140 · 140-141 °C
- Density
- 1.285 · 1.285
- storage temp.
- 2 · 2-8°C(protect from light)
- pka
- 9.575 · 9.575±0.10(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers16 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
济南腾源化工科技有限公司0531-88062576 13791023792 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
郑州如科生物科技有限公司15981811963 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
河南奥创化工有限公司+86-0371-63689365 +8618638391208 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
郑州研德生物科技有限公司13298105281 · [email protected]
Dideu Industries Group Limited+8617392712697 · [email protected]
Related reactions
5 records
Compound notes
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