50672-84-9 price
1.Introduction of 50672-84-9
1-Naphthalenecarboxaldehyde, 4-bromo- has the CAS registry number of 50672-84-9. Its
systematic na
1. Introduction of 50672-84-9
1-Naphthalenecarboxaldehyde, 4-bromo- has the CAS registry number of 50672-84-9. Its
systematic name is 4-bromo-1-naphthaldehyde. It also has synonyms of 4-bromonaphthaldehyde, 4-bromo-[1]naphthaldehyde, 4-Brom-[1]naphthaldehyd, 4-bromo-1-naphthalenecarboxaldehyde, 4-bromo-naphthalene-1-carbaldehyde, 4-bromo-1-naphthalenecarbaldehyde. Our product in the market is a kind of white powder with purity of 99.0%.
2.Properties of 50672-84-9
ACD/LogP: 3.472
# of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 3.47
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 5.5): 256.45
ACD/BCF (pH 7.4): 256.45
ACD/KOC (pH 5.5): 1844.90
ACD/KOC (pH 7.4): 1844.90
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
Polar Surface Area: 17.07 ?2
Index of Refraction: 1.7
Molar Refractivity: 58.538 cm3
Molar Volume: 151.4 cm3
Polarizability: 23.206 10-24cm3
Surface Tension: 52.0499992370605 dyne/cm
Density: 1.553 g/cm3
Flash Point: 128.456 °C
Enthalpy of Vaporization: 60.505 kJ/mol
Boiling Point: 359.449 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
3.Structure Descriptors of 50672-84-9
(1)SMILES:O=Cc2c1ccccc1c(Br)cc2
(2)Std. InChI:InChI=1S/C11H7BrO/c12-11-6-5-8(7-13)9-3-1-2-4-10(9)11/h1-7H
(3)Std. InChIKey:SESASPRCAIMYLA-UHFFFAOYSA-N
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