3,3'-Dipropyloxacarbocyanine iodide supplier

Name
3,3'-DIPROPYLOXACARBOCYANINE IODIDE
EINECS
CAS No. 53213-79-9
Density
Solubility DMSO: soluble
Melting Point 283 °C (dec.)(lit.)
Formula C₂₃H₂₅N₂O₂^.I
Boiling Point
Molecular Weight 488.3613
Flash Point
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Benzoxazolium,3-propyl-2-[3-(3-propyl-2(3H)-benzoxazolylidene)-1-propenyl]-, iodide (9CI);FD5330;
PSA 35.09000
LogP 1.86700

3,3'-Dipropyloxacarbocyanine iodide Specification

The CAS register number of 3,3'-Dipropyloxacarbocyanine iodide is 53213-79-9. It also can be called as 3-Propyl-2-[3-[3-propyl-2(3H)-benzoxazolylidene]-1-propenyl]benzoxazolium iodide and the systematic name about this chemical is 3-propyl-2-[(1E,3E)-3-(3-propyl-1,3-benzoxazol-2(3H)-ylidene)prop-1-en-1-yl]-1,3-benzoxazol-3-ium iodide. The molecular formula about this chemical is C₂₃H₂₅N₂O₂^.I and the molecular weight is 488.36.

Physical properties about 3,3'-Dipropyloxacarbocyanine iodide are: (1)#H bond acceptors: 4; (2)#Freely Rotating Bonds: 6; (3)Polar Surface Area: 29.49Å².

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [I-].O\1c4ccccc4N(C/1=C/C=C/c3oc2ccccc2[n+]3CCC)CCC
(2)InChI: InChI=1/C23H25N2O2.HI/c1-3-16-24-18-10-5-7-12-20(18)26-22(24)14-9-15-23-25(17-4-2)19-11-6-8-13-21(19)27-23;/h5-15H,3-4,16-17H2,1-2H3;1H/q+1;/p-1
(3)InChIKey: LWWWYHFXRJVZBL-REWHXWOFAH
(4)Std. InChI: InChI=1S/C23H25N2O2.HI/c1-3-16-24-18-10-5-7-12-20(18)26-22(24)14-9-15-23-25(17-4-2)19-11-6-8-13-21(19)27-23;/h5-15H,3-4,16-17H2,1-2H3;1H/q+1;/p-1
(5)Std. InChIKey: LWWWYHFXRJVZBL-UHFFFAOYSA-M

Product Name

3,3'-DIPROPYLOXACARBOCYANINE IODIDE

3,3'-Dipropyloxacarbocyanine iodide Specification

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