Hydroxocobalamin

Basic Information

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CAS Number

13422-51-0

Molecular Formula

C62H96CoN13O15P

Molecular Weight

1353.41 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Solubility

methanol: 10 mg/mL at 20 °C, clear, dark red

SMILES

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CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=N6)C(=C7C(C(C(=N7)C=C8C(C(C(=N8)C(=C4[N-]5)C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[OH-].[Co+3]

InChI

InChI=1S/C62H90N13O14P.Co.H2O/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H15,63,64,65,66,67,68,69,71,72,73,74,77,78,79,80,81,82,83,85,86);;1H2/q;+3;/p-3/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;;/m1../s1

InChIKey

YOZNUFWCRFCGIH-WZHZPDAFSA-K

LogP

6.43870

Complexity

3140

Synonyms & References

English

Neo-cytamen
B03BA03
AKOS016009334
EINECS 236-533-2
HYDROXOCOBALAMIN (USP MONOGRAPH)
HYDROXOCOBALAMIN [MART.]
HYDROXOCOBALAMIN (MART.)
Hydrobamine
HYDROXOCOBALAMIN
Hydroxocobalaminum [INN-Latin]
Sytobex-H
UNII-Q40X8H422O
Hydroxycobalamine
Lyovit-H
HYDROXOCOBALAMIN [EMA EPAR]
Hydroxocobemine
Ducobee-Hy
Neo-rojamin
Idrossocobalamina
Docelvita
Primabalt RP
HYDROXOCOBALAMIN [HSDB]
Hydrocobalamin
Hydroxomin
Hydroxy vitamin B12
Oxobemin
Hydroxycobalamin
CYANOCOBALAMIN IMPURITY H [EP IMPURITY]
Oxolamine (arcum)
Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-hydroxocobamide
Duralta-12

MDL Number

MFCD09029250

FAQ

What regulatory guidelines apply to hydroxocobalamin (CAS: 13422-51-0)?

Hydroxocobalamin (CAS: 13422-51-0) is regulated under the Globally Harmonized System (GHS) for Classification and Labeling of Chemicals, REACH regulations in the EU, and FDA/EPA guidelines for cosmetics and pharmaceuticals. Compliance is essential to ensure product safety and legal marketing.

Are there alternatives to hydroxocobalamin (CAS: 13422-51-0) in synthesis?

Alternative reagents for synthesizing hydroxocobalamin include analogs like methylcobalamin and synthetic pathways using vitamin B12 precursors. These alternatives can offer similar functionalities, but the choice depends on specific application requirements and cost considerations.

What is the market or research trend for hydroxocobalamin (CAS: 13422-51-0)?

The market for hydroxocobalamin (CAS: 13422-51-0) is growing due to increasing demand in cosmeceuticals and pharmaceutical industries. Research trends focus on its bioavailability, effectiveness in skin care, and potential therapeutic applications in neurological disorders.

How should waste containing hydroxocobalamin (CAS: 13422-51-0) be handled?

Waste containing hydroxocobalamin (CAS: 13422-51-0) should be collected in designated containers and disposed of through professional waste disposal services. Incineration or safe chemical neutralization methods are recommended to ensure environmental protection and compliance with local regulations.