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Liquid Crystals
4,4'-Azoxydiphenetole
Cas#: 4792-83-0
Compound CID:
78520
Formula:
C16 H18 N2 O3
Molecular Weight: 286.333
IUPAC Name: (4-ethoxyphenyl)-(4-ethoxyphenyl)imino-oxidoazanium
SMILES: CCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCC)[O-]
InChIKey: QUICZVHSJNKDBL-UHFFFAOYSA-N
InChI: InChI=1S/C16H18N2O3/c1-3-20-15-9-5-13(6-10-15)17-18(19)14-7-11-16(12-8-14)21-4-2/h5-12H,3-4H2,1-2H3
Synonyms: PAP | ADP | (z)-(4-ethoxyphenyl)-(4-ethoxyphenyl)imino-oxido-ammonium | p-Azoxyphenetol | (1Z)-bis(4-ethoxyphenyl)dia...
4-IODO-4'-NITROBIPHENYL
Cas#: 29170-08-9
Compound CID:
120142
Formula:
C12 H8 INO2
Molecular Weight: 325.107
IUPAC Name: 1-(4-iodophenyl)-4-nitrobenzene
SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)I)[N+](=O)[O-]
InChIKey: YEDVRRNLTGKJSW-UHFFFAOYSA-N
InChI: InChI=1S/C12H8INO2/c13-11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(15)16/h1-8H
Synonyms: CS-W013941 | BIM-0014002.P001 | NCGC00016015-03 | I0537 | 9H-9,9c-Iminoethanophenanthro(4,5-bcd)furan-3,5-diol, 4a,5,...
4-Iodoanisole
Cas#: 696-62-8
Compound CID:
69676
Formula:
IC6 H4 OCH3
Molecular Weight: 234.03
IUPAC Name: 1-iodo-4-methoxybenzene
SMILES: COC1=CC=C(C=C1)I
InChIKey: SYSZENVIJHPFNL-UHFFFAOYSA-N
InChI: InChI=1S/C7H7IO/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3
Synonyms: 4-Iodoanisole|696-62-8|1-Iodo-4-methoxybenzene|p-Iodoanisole|Benzene, 1-iodo-4-methoxy-|Isoform|4-Methoxyiodobenzene|...
p-Anisidine
Cas#: 104-94-9
Compound CID:
7732
Formula:
C7 H9 NO
Molecular Weight: 123.15
IUPAC Name: 4-methoxyaniline
SMILES: COC1=CC=C(C=C1)N
InChIKey: BHAAPTBBJKJZER-UHFFFAOYSA-N
InChI: InChI=1S/C7H9NO/c1-9-7-4-2-6(8)3-5-7/h2-5H,8H2,1H3
Synonyms: InChI=1/C7H9NO/c1-9-7-4-2-6(8)3-5-7/h2-5H,8H2,1H | STR00220 | para-methoxy aniline | p-Methoxyaniline | p-methoxy-ani...
4-(trans-4-Pentylcyclohexyl)benzonitrile
Cas#: 61204-01-1
Compound CID:
109063
Formula:
CH3 (CH2 )4 C6 H10 C6 H4 CN
Molecular Weight: 255.4
IUPAC Name: 4-(4-pentylcyclohexyl)benzonitrile
SMILES: CCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N
InChIKey: FURZYCFZFBYJBT-UHFFFAOYSA-N
InChI: InChI=1S/C18H25N/c1-2-3-4-5-15-6-10-17(11-7-15)18-12-8-16(14-19)9-13-18/h8-9,12-13,15,17H,2-7,10-11H2,1H3
Synonyms: 4-(1-Methyl-2-oxohydrazino)-1-(3-pyridinyl)-1-butanone # | MFCD00075548 | Foscarnet sodium Assay Standard | Cyclohexa...
4-Heptylbenzoicacid
Cas#: 38350-87-7
Compound CID:
170036
Formula:
CH3 (CH2 )6 C6 H4 CO2 H
Molecular Weight: 220.31
IUPAC Name: 4-heptylbenzoic acid
SMILES: CCCCCCCC1=CC=C(C=C1)C(=O)O
InChIKey: VSUKEWPHURLYTK-UHFFFAOYSA-N
InChI: InChI=1S/C14H20O2/c1-2-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16/h8-11H,2-7H2,1H3,(H,15,16)
Synonyms: AS-57329 | W-106490 | A824118 | 4-Heptylbenzoic acid, 97% | EINECS 253-894-1 | MFCD00009722 | Benzoic acid, 4-heptyl-...
trans-4-Ethylcyclohexanecarboxylic Acid
Cas#: 6833-47-2
Compound CID:
1490288
Formula:
C9 H16 O2
Molecular Weight: 156.23
IUPAC Name: 4-ethylcyclohexane-1-carboxylic acid
SMILES: CCC1CCC(CC1)C(=O)O
InChIKey: UNROFSAOTBVBBT-UHFFFAOYSA-N
InChI: InChI=1S/C9H16O2/c1-2-7-3-5-8(6-4-7)9(10)11/h7-8H,2-6H2,1H3,(H,10,11)
Synonyms: SCHEMBL879831 | 4-ethylcyclohexane-1-carboxylic acid | CS-W018003 | F16511 | SY113622 | DTXSID80987865 | (1r,4r)-4-et...
4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-4'-ethyl-3,5-difluorobiphenyl
Cas#: 303186-19-8
Compound CID:
58402371
Formula:
C21 H13 F7 O
Molecular Weight: 414.32
IUPAC Name: 2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-5-(4-ethylphenyl)-1,3-difluorobenzene
SMILES: CCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F
InChIKey: ZTUBOAYBUBUTPH-UHFFFAOYSA-N
InChI: InChI=1S/C21H13F7O/c1-2-11-3-5-12(6-4-11)13-7-15(22)19(16(23)8-13)21(27,28)29-14-9-17(24)20(26)18(25)10-14/h3-10H,2H2,1H3
Synonyms: 4-(Difluoro(3,4,5-trifluorophenoxy)methyl)-4'-ethyl-3,5-difluoro-1,1'-biphenyl | 4-[Difluoro(3,4,5-trifluorophenoxy)m...
(S)-(+)-6-Methyl-1-octanol
Cas#: 110453-78-6
Compound CID:
13548104
Formula:
C9 H20 O
Molecular Weight: 144.26
IUPAC Name: (6S)-6-methyloctan-1-ol
SMILES: CCC(C)CCCCCO
InChIKey: WWRGKAMABZHMCN-VIFPVBQESA-N
InChI: InChI=1S/C9H20O/c1-3-9(2)7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/t9-/m0/s1
Synonyms: 6-Methyl-1-octanol # | J-002430 | 1-Octanol, 6-methyl-,(6S)- | (S)-6-methyloctan-1-ol | M0966 | WWRGKAMABZHMCN-VIFPVB...
(S)-(+)-3-Methyl-1-pentanol
Cas#: 42072-39-9
Compound CID:
641003
Formula:
C6 H14 O
Molecular Weight: 102.18
IUPAC Name: (3S)-3-methylpentan-1-ol
SMILES: CCC(C)CCO
InChIKey: IWTBVKIGCDZRPL-LURJTMIESA-N
InChI: InChI=1S/C6H14O/c1-3-6(2)4-5-7/h6-7H,3-5H2,1-2H3/t6-/m0/s1
Synonyms: T72450 | (3S)-3-methylpentan-1-ol | AKOS015840016 | 3-Methyl-1-pentanol # | (S)-3-methylpentanol | MFCD00135167 | A68...
4′-Heptyl-4-biphenylcarbonitrile
Cas#: 41122-71-8
Compound CID:
170468
Formula:
CH3 (CH2 )6 C6 H4 C6 H4 CN
Molecular Weight: 277.4
IUPAC Name: 4-(4-heptylphenyl)benzonitrile
SMILES: CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChIKey: ZGOWXOZNUNZPAV-UHFFFAOYSA-N
InChI: InChI=1S/C20H23N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8-15H,2-7H2,1H3
Synonyms: 4'-Heptyl-[1,1'-biphenyl]-4-carbonitrile | EINECS 255-229-0 | 4-Cyano-4 inverted exclamation marka-n-heptylbiphenyl |...
4′-Hexyl-4-biphenylcarbonitrile
Cas#: 41122-70-7
Compound CID:
38764
Formula:
CH3 (CH2 )5 C6 H4 C6 H4 CN
Molecular Weight: 263.38
IUPAC Name: 4-(4-hexylphenyl)benzonitrile
SMILES: CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChIKey: VADSDVGLFDVIMG-UHFFFAOYSA-N
InChI: InChI=1S/C19H21N/c1-2-3-4-5-6-16-7-11-18(12-8-16)19-13-9-17(15-20)10-14-19/h7-14H,2-6H2,1H3
Synonyms: Tox21_201123 | 1,1'-Biphenyl, 4-cyano-4'-hexyl- | CAS-41122-70-7 | 6CB | (1,1'-Biphenyl)-4-Carbonitrile, 4'-Hexyl-;4-...
