Pyrromethene 650

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Pyrromethene 650

Pyrromethene 650 | 157410-23-6

Catalog Number F01-0160
Category BODIPY
Molecular Formula C16H18BF2N3
Molecular Weight 301.148
Catalog Number Size Price Quantity
F01-0160 -- $--

Product Introduction

Pyrromethene 650 can be used as a laser dye.

Chemical Information

Synonyms 1,2,3,5,6,7-hexamethyl-8-cyanopyrromethene-difluoroborate; PM-HMC; [[(3,4,5-Trimethyl-1H-pyrrol-2-yl)(3,4,5-trimethyl-2H-pyrrol-2-ylidene)methyl]carbonitrile](difluoroborane)
IUPAC Name 2,2-difluoro-4,5,6,10,11,12-hexamethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaene-8-carbonitrile
Canonical SMILES [B-]1(N2C(=C(C(=C2C(=C3[N+]1=C(C(=C3C)C)C)C#N)C)C)C)(F)F
InChI InChI=1S/C16H18BF2N3/c1-8-10(3)15-14(7-20)16-11(4)9(2)13(6)22(16)17(18,19)21(15)12(8)5/h1-6H3
InChI Key LXNVCQRKLGCOPW-UHFFFAOYSA-N
  • Product Specification
Signal Warning
GHS Hazard Statements H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (The corresponding statement to each P-code can be found at the GHS Classification page.)

Computed Properties

Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 301.1561841 g/mol
Monoisotopic Mass 301.1561841 g/mol
Topological Polar Surface Area 31.7Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 663
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
US-2019074657-A1 Random Lasing Photo-Curable Composition for Use as Random Lasing Gain Medium 2016-04-21
US-2003113667-A1 Method of preparing planographic printing plate 2001-08-28
US-6730455-B2 Method of preparing planographic printing plate 2001-08-28
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