Basic information
- CAS
448-71-5- Standard SMILES
CCC1=C(C)c2cc3[nH]c(cc4[nH]c(cc5nc(cc1n2)C(C)=C5CC)c(C)c4CC)c(C)c3CC- InChIKey
VIXIHEJFGRACDI-GCISPZHASA-N- Molecular formula
- C32H38N4
- Average molar mass
- 478.7 g/mol
- Monoisotopic mass
- 478.30964723
Names & identifiers
- Preferred name
- Etioporphyrin I
- IUPAC
- 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21,22-dihydroporphyrin
- English name
- ETIOPORPHYRIN I
- Molecular formula
- C32H38N4
- Molecular weight
- 478.67
Names & synonyms
ETIOPORPHYRIN I448-71-52,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21,22-dihydroporphyrin21H,23H-Porphine, 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-2,7,12,17-Tetraethyl-3,8,13,18-tetramethyl-21H,23H-porphinAtioporphyrin IETIOPORPHYRINIorb2939534SCHEMBL1287828SCHEMBL1287831SCHEMBL29509969VIXIHEJFGRACDI-GCISPZHASA-N
Show more names
Etioporphyrinethioporphyrin IMesoetioporphyrin2,7,12,17-TETRAETHYL-3,8,13,18-TETRAMETHYL-21H,23H-PORPHINE2,7,12,17-Tetraethyl-3,8,13,18-tetramethyl-21H,23H-porphyrin2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21,22-dihydroporphine
TYD-01066HY-W127800CS-01859703,8,13,18-Tetraethyl-2,7,12,17-tetramethyl-21H,23H-porphine
Database identifiers
- CAS
448-71-5- PubChem CID
- 79013
- Nikkaji
- J11.373E、J508.709K、J510.849G
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 727
Physicochemical properties
- Melting point
- 400 °C · >400 °C
- Boiling point
- 792.7 · 792.7±55.0 °C(Predicted)
- Density
- 1.101 · 1.101±0.06 g/cm3(Predicted)
- FDA UNII
- 7 PVC95X · YWM7PVC95X
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-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
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesEtioporphyrin I is used as a phosporescent when complexed with certain metals.
Suppliers11 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
成都安斯利生物医药有限公司028-85305008 02885305008 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
重庆博涛生物科技有限公司15223382610 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Chengdu Aslee Biopharmaceuticals, Inc.28-85305008
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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