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2,6,10,14,18,22,26,30,31-Nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl octadecanoate

2,6,10,14,18,22,26,30,31-Nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl octadecanoate structure

CAS No:
94023-28-6
Formula:
C42H84O18
Chemical Name:
2,6,10,14,18,22,26,30,31-Nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl octadecanoate
Synonyms:
Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl ester;2,6,10,14,18,22,26,30,31-Nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl octadecanoate

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2,6,10,14,18,22,26,30,31-Nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl octadecanoate Basic Attributes

Molecular Weight：

877.10600

Exact Mass：

877.11

EC Number：

301-625-4

Characteristics

PSA：

272.98000

XLogP3：

0.78680

Density：

1.168g/cm3

Boiling Point：

933ºC

Flash Point：

260.3ºC

Refractive Index：

1.509

Computed Properties

Molecular Weight:877.1
XLogP3:2.1
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:48
Exact Mass:876.56576583
Monoisotopic Mass:876.56576583
Topological Polar Surface Area:273
Heavy Atom Count:60
Complexity:907
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,6,10,14,18,22,26,30,31-Nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-yl octadecanoate

Basic Attributes
Characteristics
Computed Properties
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