Basic information
- CAS
2252330-85-9- Standard SMILES
O=C(O)CCOCCOCCOCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21- InChIKey
ADXLVCTYGZKIQE-IPJJNNNSSA-N- Molecular formula
- C23H41N3O9S
- Average molar mass
- 535.7 g/mol
- Monoisotopic mass
- 535.25635107
Names & identifiers
- Preferred name
- 20-Oxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-4,7,10,13,16-pentaoxa-19-azatetracosanoic acid
- IUPAC
- 3-[2-[2-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
- English name
- Biotin-PEG5-CH2CH2COOH
- Molecular formula
- C23H41N3O9S
- Molecular weight
- 535.65
Names & synonyms
2252330-85-9Biotin-PEG5-acidBiotin-PEG5-CH2CH2COOH20-Oxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-4,7,10,13,16-pentaoxa-19-azatetracosanoic acidMFCD233785553-[2-[2-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acidBiotin-PEG5-C2-COOHorb3137751C23H41N3O9STCL-01840AS-96418BP-45059
Show more names
Biotin-PEG5-PABiotin PEG5-C2-COOHBiotin-PEG5-CH2CH2COOH/20-Oxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-4,7,10,13,16-pentaoxa-19-azatetracosan-1-oic acid
SY318409C90660
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 179 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 23
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 644
Physicochemical properties
- Boiling point
- 800.9 · 800.9±65.0 °C(Predicted)
- Density
- 1.203 · 1.203±0.06 g/cm3(Predicted)
- pka
- 4.28 · 4.28±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers24 total
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
成都翰唯生物科技有限公司17360178904 18217049878 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
扬州济德康瑞生物科技有限公司15029750239 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
武汉翱联生物科技有限公司15841022315 15841022315 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
武汉翱飞科技有限公司15841022315 · [email protected]
Xian confluore Biological Technology Co., Ltd.+86-15680926068 · [email protected]
南京佰瑞利康生物科技有限公司18168036974 · [email protected]
成都叮当时代医药科技有限公司028-86040038 · [email protected]
苏州名德生物科技有限公司13915541704 · [email protected]
成都英诺凌医药科技有限公司17882285575 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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