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IR 780

IR 780 structure

CAS No:
207399-07-3
Formula:
C36H44ClN2.I
Chemical Name:
IR 780
Synonyms:
3H-Indolium,2-[2-[2-chloro-3-[2-(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-propyl-,iodide (1:1);3H-Indolium,2-[2-[2-chloro-3-[(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-propyl-,iodide;IR 780 iodide;IR 780;ADS 775PI;223714-76-9;1888323-49-6;2231085-77-9

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IR 780 Basic Attributes

Molecular Weight：

667.11

Exact Mass：

666.22400

HScode：

29339900

Characteristics

PSA：

6.25000

XLogP3：

6.75170

Appearance：

solid

Melting Point：

232-234 °C(lit.)

Water Solubility：

It is soluble in methanol.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

22-24/25-60-37-26-23

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|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

IR 780 Use and Manufacturing

Uses

Infrared laser dye.

Manufacturing Info：

3H-Indolium, 2-[2-[2-chloro-3-[2-(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-propyl-, iodide (1:1): ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:667.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:666.22377
Monoisotopic Mass:666.22377
Topological Polar Surface Area:6.2
Heavy Atom Count:40
Complexity:990
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Recommended Suppliers of IR 780

HANGZHOU LEAP CHEM CO., LTD. Contact Supplier

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IR-780 iodide

CAS No.: 207399-07-3

Content: 99.00%

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Guide of IR 780

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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IR 780

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