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4-Isocyanato-4-propylheptane

4-Isocyanato-4-propylheptane structure

CAS No:
56065-35-1
Formula:
C11H21NO
Chemical Name:
4-Isocyanato-4-propylheptane
Synonyms:
Heptane,4-isocyanato-4-propyl-;4-Isocyanato-4-propylheptane;1,1-Dipropylbutyl isocyanate

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4-Isocyanato-4-propylheptane Basic Attributes

Molecular Weight：

183.29 g/mol

Exact Mass：

183.29

EC Number：

259-976-3

DSSTox ID：

DTXSID50204612

Characteristics

PSA：

29.4 Å²

Boiling Point：

65-66 °C @ Press: 2 Torr

Computed Properties

Molecular Weight:183.29
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:183.162314293
Monoisotopic Mass:183.162314293
Topological Polar Surface Area:29.4
Heavy Atom Count:13
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Isocyanato-4-propylheptane

Basic Attributes
Characteristics
Computed Properties

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