Chem
J-GLOBAL ID:200907052556785104
Nikkaji number:J1.954B
Isophorone
イソホロン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C9 H14 O
Molecular formula furigana:
C9-H14-O
Molecular weight:
138.210
InChI:
InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChI key:
HJOVHMDZYOCNQW-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)CC(C)(C)C1
Systematic name (6):
3,5,5-トリメチルシクロヘキサ-2-エン-1-オン
1,5,5-トリメチル-1-シクロヘキセン-3-オン
1,1,3-トリメチル-3-シクロヘキセン-5-オン
1,5,5-トリメチルシクロヘキセン-3-オン
3,5,5-トリメチル-2-シクロヘキセン-1-オン
3,5,5-trimethylcyclohex-2-en-1-one
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Other name (16):
イソホロン
イソアセトフロン
Isophorone
Isoacetophrone
3,5,5-Trimethyl-2-cyclohexen-1-one
NCI-C-55618
1,1,3-Trimethyl-3-cyclohexen-5-one
1,5,5-Trimethylcyclohexen-3-one
α-イソホロン
イソアセトホロン
Isophoron
Isoforon
α-Isophorone
α-Isophoron
Isoacetophorone
ST-138
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CAS registry number:
78-59-1
Regulation number (5):
(3)-2381
(3)-2389
GW7700000
EINECS2011260
TSCA(78-59-1)
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