CAS 1498-88-0 1,3,3-Trimethylindolino-6'-nitrobenzopyrylospiran, [Photochromic Compound]

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1,3,3-Trimethylindolino-6'-nitrobenzopyrylospiran, [Photochromic Compound]

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Catalog Number

ACM1498880-1

CAS Number

1498-88-0

Product Name

1,3,3-Trimethylindolino-6'-nitrobenzopyrylospiran, [Photochromic Compound]

Structure

Category

Photochromic Materials

IUPAC Name

1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indole]

Molecular Weight

322.4g/mol

Molecular Formula

C19H18N2O3

Canonical SMILES

CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C=CC(=C4)[N+](=O)[O-])C)C

InChI

InChI=1S/C19H18N2O3/c1-18(2)15-6-4-5-7-16(15)20(3)19(18)11-10-13-12-14(21(22)23)8-9-17(13)24-19/h4-12H,1-3H3

InChI Key

PSXPTGAEJZYNFI-UHFFFAOYSA-N

Complexity

555

Covalently-Bonded Unit Count

EC Number

216-102-5

Exact Mass

322.131742g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

1',3',3'-trimethyl-6-nitroindolene-2-spiro-2-benzopyran;1,3,3-trimetylindolino-6-nitro benzopyrylospiran;6-NO2-BIPS;TMINBPS;TNSB

Monoisotopic Mass

322.131742g/mol

NSC Number

206176

Rotatable Bond Count

XLogP3

4.8

MSDS

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COA

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Spec Sheet

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