Chem
J-GLOBAL ID:200907002724251474
Nikkaji number:J2.681.488J
1,2,3,4,10,10-Hexachloro-9-butoxy-1,4,4aα,5,8,8aα-hexahydro-1α,4α:5α,8α-dimethanonaphthalene
1,2,3,4,10,10-ヘキサクロロ-9-ブトキシ-1,4,4aα,5,8,8aα-ヘキサヒドロ-1α,4α:5α,8α-ジメタノナフタレン
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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:
C16 H16 Cl6 O
Molecular formula furigana:
C16-H16-CL6-O
Molecular weight:
437.000
InChI:
InChI=1S/C16H16Cl6O/c1-2-3-6-23-11-7-4-5-8(11)10-9(7)14(19)12(17)13(18)15(10,20)16(14,21)22/h4-5,7-11H,2-3,6H2,1H3/t7-,8+,9+,10-,11?,14+,15-
InChI key:
QXWVTISBQAGLCS-WOHLNSRASA-N
SMILES:
CCCCOC1[C@@H]2C=C[C@H]1[C@@H]1[C@H]2[C@]2(Cl)C(=C(Cl)[C@@]1(Cl)C2(Cl)Cl)Cl
Systematic name (3):
1,2,3,4,10,10-ヘキサクロロ-9-ブトキシ-1,4,4aα,5,8,8aα-ヘキサヒドロ-1α,4α:5α,8α-ジメタノナフタレン
(1R,2R,3S,6R,7S,8S)-12-ブトキシ-1,8,9,10,11,11-ヘキサクロロテトラシクロ[6.2.1.13,6 .02,7 ]ドデカ-4,9-ジエン
(1R,2R,3S,6R,7S,8S)-12-butoxy-1,8,9,10,11,11-hexachlorotetracyclo[6.2.1.13,6 .02,7 ]dodeca-4,9-diene
Other name (1):
1,2,3,4,10,10-Hexachloro-9-butoxy-1,4,4aα,5,8,8aα-hexahydro-1α,4α:5α,8α-dimethanonaphthalene
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