2,9-Dimethyl-1,10-phenanthroline hemihydrate, 98%

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CAS
34302-69-7
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Catalog Number

ACM34302697

Product Name

2,9-Dimethyl-1,10-phenanthroline hemihydrate, 98%

Structure

CAS

34302-69-7

Category

Heterocyclic Organic Compound

Synonyms

UNII-2SDT9EV86W;34302-69-7;2SDT9EV86W;Neocuproine hemihydrate, 99+%;MFCD00149306;Neocuproine hemihydrate [MI];1,10-Phenanthroline, 2,9-dimethyl-, hemihydrate;1,10-Phenanthroline, 2,9-dimethyl-, hydrate (2:1);SCHEMBL8652007;

IUPAC Name

2,9-dimethyl-1,10-phenanthroline;hydrate;

Molecular Weight

434.543g/mol

Molecular Formula

C28H26N4O;

Canonical SMILES

CC1=NC2=C(C=C1)C=CC3=C2N=C(C=C3)C.CC1=NC2=C(C=C1)C=CC3=C2N=C(C=C3)C.O;

InChI

InChI=1S/2C14H12N2.H₂O/c2*1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9;/h2*3-8H,1-2H3;1H2;

InChI Key

IEBXFSLFDFHSRD-UHFFFAOYSA-N;

Complexity

227

Covalently-Bonded Unit Count

Exact Mass

434.211g/mol

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

434.211g/mol

Topological Polar Surface Area

52.6A^2

UNII

2SDT9EV86W

MSDS

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COA

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Spec Sheet

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