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Name

3-Octadecyl-2-[3-(3-octadecyl-2(3H)-benzoxazolylidene)-1-propen-1-yl]benzoxazolium perchlorate

EINECS

N/A

CAS No.

34215-57-1

Density

g/cm³

PSA

109.36000

LogP

16.78030

Solubility

N/A

Melting Point

N/A

Formula

C₅₃H₈₅ClN₂O₆

Boiling Point

°Cat760mmHg

Molecular Weight

881.7

Flash Point

°C

Transport Information

N/A

Appearance

N/A

Safety

Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	26-36/37/39
RIDADR	1479
WGK Germany	3
F	8
HazardClass	5.1
PackingGroup	III

Risk Codes

36/37/38

Molecular Structure

Hazard Symbols

Synonyms

3,3'-dioctadecyloxacarbocyanine;3,3'-dioctadecyloxacarbocyanine perchlorate;diO-3,3';DIOC18 compound

3-Octadecyl-2-[3-(3-octadecyl-2(3H)-benzoxazolylidene)-1-propen-1-yl]benzoxazolium perchlorate Chemical Properties

Molecular Structure:

Molecular Formula: C₅₃H₈₅ClN₂O₆
Molecular Weight: 881.7048
Systematic Name: 3-Octadecyl-2-[(1E,3Z)-3-(3-octadecyl-1,3-benzoxazol-2(3H)-ylidene)prop-1-en-1-yl]-1,3-benzoxazol-3-ium perchlorate
Synonyms of 3-Octadecyl-2-[3-(3-octadecyl-2(3H)-benzoxazolylidene)-1-propen-1-yl]benzoxazolium perchlorate (CAS NO.34215-57-1): 3,3’-Dioctadecyloxacarbocyanine ; N,N'-Dioctadecyloxacarbocyanine perchlorate ; NK 3045 ; Dioc18(3) ; Dio ; D275 ; Benzoxazolium, 3-octadecyl-2-[3-(3-octadecyl-2(3h)-benzoxazolylidene)-1-propenyl]-, perchlorate ; Benzoxazolium, 3-octadecyl-2-[3-(3-octadecyl-2-benzoxazolinylidene)propenyl]-, perchlorate
CAS NO: 34215-57-1
H bond acceptors: 8
H bond donors: 1
Freely Rotating Bonds: 36
Polar Surface Area: 103.76 Å2

3-Octadecyl-2-[3-(3-octadecyl-2(3H)-benzoxazolylidene)-1-propen-1-yl]benzoxazolium perchlorate Safety Profile

Hazard Codes of 3-Octadecyl-2-[3-(3-octadecyl-2(3H)-benzoxazolylidene)-1-propen-1-yl]benzoxazolium perchlorate (CAS NO.34215-57-1): Irritant Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
RIDADR: 1479
WGK Germany: 3
F: 8
HazardClass: 5.1
PackingGroup: III

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