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(5E,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one

(5E,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one structure

CAS No:
3953-35-3
Formula:
C18H30O
Chemical Name:
(5E,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one
Synonyms:
UNII-3KCT4WMT7E;(5E,9Z)-farnesyl acetone;(5E,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one;3KCT4WMT7E;3953-35-3;6,10,14-Trimethyl-5,9,13-pentadecatrien-2-one;farnesylaceton;Farnesyl acetone, (5e,9Z)-;FEMA No. 3442, (5e,9Z)-;SCHEMBL14236986;CHEBI:176714;5,9,13-Pentadecatrien-2-one, 6,10,14-trimethyl-, (5E,9Z)-;5,9,13-Pentadecatrien-2-one, 6,10,14-trimethyl-, (E,Z)-;ZINC14822753;Q27257403;UNII-26A08O86E6 component LTUMRKDLVGQMJU-HSVQFRAPSA-N

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Description

(5E,9Z)-farnesyl acetone is a diterpenoid.

(5E,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one Basic Attributes

Molecular Weight：

262.4 g/mol

Exact Mass：

262.229665576 g/mol

UNII：

3KCT4WMT7E

Characteristics

PSA：

17.1 Å²

XLogP3：

5.721 (est)

Boiling Point：

147.00to148.00°C.@0.50mmHg

Water Solubility：

0.04178 mg/L @ 25 °C (est)

Computed Properties

Molecular Weight:262.4
XLogP3:5.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:9
Exact Mass:262.229665576
Monoisotopic Mass:262.229665576
Topological Polar Surface Area:17.1
Heavy Atom Count:19
Complexity:352
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (5E,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one

Description
Basic Attributes
Characteristics
Computed Properties

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