3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid
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![3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cca28521bbae411c8fd55aa7f315fff9.png "3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid")
3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid
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CAS No:
142234-85-3
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Formula:
C35H40N4O4
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Chemical Name:
3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid
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Synonyms:
21-Methylmesoporphyrin;SCHEMBL505199;DB01911;3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid;J2.132.966E;3,8,13,17,23-Pentamethyl-7,12-diethyl-21H,23H-porphyrin-2,18-dipropanoic acid
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CAS No:
3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid Basic Attributes
580.7 g/mol
580.30495577 g/mol
DTXSID70349630
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:580.7
XLogP3:4.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:580.30495577
Monoisotopic Mass:580.30495577
Topological Polar Surface Area:121
Heavy Atom Count:43
Complexity:980
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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