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Hematin

Hematin structure

CAS No:
15489-90-4
Formula:
C34H31FeN4O5.2H
Chemical Name:
Hematin
Synonyms:
Ferrate(2-),[7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-κN21,κN22,κN23,κN24]hydroxy-,hydrogen (1:2),(SP-5-13)-;Hematin;Iron,[dihydrogen 3,7,12,17-tetramethyl-8,13-divinyl-2,18-porphinedipropionato(2-)]hydroxy-;Ferrate(2-),[7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N21,N22,N23,N24]hydroxy-,dihydrogen,(SP-5-13)-;Ferrihemic acid;Ferrate(2-),[7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-κN21,κN22,κN23,κN24]hydroxy-,dihydrogen,(SP-5-13)-;21H,23H-Porphine-2,18-dipropanoic acid,7,12-diethenyl-3,8,13,17-tetramethyl-,iron complex;Protohematin;Ferriprotoporphyrin basic;Ferrihemate;Hydroxy[dihydrogen protoporphyrin IX-ato(2-)]iron;Ferriheme hydroxide;Ferriporphyrin hydroxide;Hydroxyhemin;Phenodin;[Dihydrogen 3,7,12,17-tetramethyl-8,13-divinyl-2,18-porphinedipropionato(2-)]hydroxyiron;Ferriprotoporphyrin IX hydroxide;Growthphyllin;Hematins;11013-41-5;13408-64-5;14654-28-5;58592-27-1
Categories:
Cosmetic Ingredient > Hair Conditioning

Description

Chloro(7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N(21),N(22),N(23),N(24)) ferrate(2-) dihydrogen.

Hematin Basic Attributes

Molecular Weight：

633.49500

Exact Mass：

634.187856 g/mol

EC Number：

239-518-9

Characteristics

PSA：

129.41000

XLogP3：

3.43290

Appearance：

Dark crystals with metalic luster

Melting Point：

180ºC

Boiling Point：

1128.5ºC at 760 mmHg

Flash Point：

636.3ºC

Storage Conditions：

2-8ºC

Vapor Pressure：

0mmHg at 25°C

Safety Information

GHS Classification：

|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.

Drug Information

MeSH Entry Terms：

Alkaline Hematin D 575

Hematin Use and Manufacturing

Use Classification：

Cosmetics -> Hair conditioning

Computed Properties

Molecular Weight:634.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:634.187856
Monoisotopic Mass:634.187856
Topological Polar Surface Area:103
Heavy Atom Count:44
Complexity:1010
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of Hematin

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
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