21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)- is a complex organic compound with a porphyrin structure. It is characterized by its unique arrangement of carbon, hydrogen, and oxygen atoms, which form a cyclic structure with various functional groups. The compound has a 7-propanoic acid chain, a 3-carboxy group, a 13-ethenyl group, and an 18-ethyl group. The 7,8-dihydro and 2,5,8,12,17-pentamethyl substitutions further define its structure. The (7S,8S) notation indicates the stereochemistry of the molecule, specifying the spatial arrangement of the atoms at the 7th and 8th positions. 21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)- is significant in various fields, including pharmaceuticals and materials science, due to its potential applications in drug development and as a building block for more complex molecules.
550-52-7
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Basic information
- Product Name: 21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)-
- Synonyms: 21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)-;(7S,8S)-3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-21H,23H-Porphine-7-propanoic acid
- CAS NO:550-52-7
- Molecular Formula: C33H36N4O4
- Molecular Weight: 552.671
- EINECS: N/A
- Product Categories: N/A
- Mol File: 550-52-7.mol
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 1046.2°C at 760 mmHg
- Flash Point: 586.5°C
- Appearance: /
- Density: 1.269g/cm3
- Vapor Pressure: 0mmHg at 25°C
- Refractive Index: 1.621
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: 21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)-(CAS DataBase Reference)
- NIST Chemistry Reference: 21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)-(550-52-7)
- EPA Substance Registry System: 21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)-(550-52-7)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 550-52-7(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 550-52-7 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 5,5 and 0 respectively; the second part has 2 digits, 5 and 2 respectively.Calculate Digit Verification of CAS Registry Number 550-52:
(5*5)+(4*5)+(3*0)+(2*5)+(1*2)=57
57 % 10 = 7
So 550-52-7 is a valid CAS Registry Number.
InChI:InChI=1/C33H36N4O4/c1-8-20-15(3)23-12-25-17(5)22(10-11-29(38)39)31(36-25)19(7)32-30(33(40)41)18(6)26(37-32)14-28-21(9-2)16(4)24(35-28)13-27(20)34-23/h8,12-14,17,22,35-36H,1,9-11H2,2-7H3,(H,38,39)(H,40,41)/b25-12-,26-14-,27-13-,31-19-/t17-,22-/m0/s1
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21H,23H-Porphine-7-propanoic acid, 3-carboxy-13-ethenyl-18-ethyl-7,8-dihydro-2,5,8,12,17-pentamethyl-, (7S,8S)-
