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Methyl-branched fatty acids
Description:
Fatty acids with an acyl chain that has a methyl branch. Usually, they are saturated and contain only one or more methyl group. However, branches other than methyl may be present.
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3，4-Dimethylpentanoic acidCas Number: 3302-06-5 Compound CID: 226113Formula: C7H14O2 Molecular Weight: 130.18IUPAC Name: 3,4-dimethylpentanoic acidSMILES: CC(C)C(C)CC(=O)OInChIKey: GETAKGOKCSRVLZ-UHFFFAOYSA-NInChI: InChI=1S/C7H14O2/c1-5(2)6(3)4-7(8)9/h5-6H,4H2,1-3H3,(H,8,9) -
3-Methylbut-3-enoic acidCas Number: 1617-31-8 Compound CID: 417575Formula: C5H8O2 Molecular Weight: 100.12IUPAC Name: 3-methylbut-3-enoic acidSMILES: CC(=C)CC(=O)OInChIKey: IGRURXZWJCSNKU-UHFFFAOYSA-NInChI: InChI=1S/C5H8O2/c1-4(2)3-5(6)7/h1,3H2,2H3,(H,6,7)
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3-Ethylpentanoic acidCas Number: 58888-87-2 Compound CID: 134460Formula: C7H14O2 Molecular Weight: 130.18IUPAC Name: 3-ethylpentanoic acidSMILES: CCC(CC)CC(=O)OInChIKey: ATUUSOSLBXVJKL-UHFFFAOYSA-NInChI: InChI=1S/C7H14O2/c1-3-6(4-2)5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
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3-((tert-butoxycarbonyl)amino)-4-methylpentanoic acidCas Number: 248924-39-2Formula: C11H21NO4 Molecular Weight: 231.29IUPAC Name: 4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acidSMILES: CC(C)C(CC(=O)O)NC(=O)OC(C)(C)CInChIKey: LUXMZCJCTUATDM-UHFFFAOYSA-NInChI: InChI=1S/C11H21NO4/c1-7(2)8(6-9(13)14)12-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)
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2，2，3，3-Tetramethylsuccinic acidCas Number: 630-51-3 Compound CID: 136453Formula: C8H14O4 Molecular Weight: 174.19IUPAC Name: 2,2,3,3-tetramethylbutanedioic acidSMILES: CC(C)(C(=O)O)C(C)(C)C(=O)OInChIKey: CDPPYCZVWYZBJH-UHFFFAOYSA-NInChI: InChI=1S/C8H14O4/c1-7(2,5(9)10)8(3,4)6(11)12/h1-4H3,(H,9,10)(H,11,12)
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2-Cyano-3-methyl-2-butenoic AcidCas Number: 759-21-7Formula: C6H7NO2 Molecular Weight: 125.13IUPAC Name: 2-cyano-3-methylbut-2-enoic acidSMILES: CC(=C(C#N)C(=O)O)CInChIKey: IMCBZLGYAYZSAM-UHFFFAOYSA-NInChI: InChI=1S/C6H7NO2/c1-4(2)5(3-7)6(8)9/h1-2H3,(H,8,9)
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4-Methylpent-3-enoic acidCas Number: 504-85-8 Compound CID: 68158Formula: C6H10O2 Molecular Weight: 114.14IUPAC Name: 4-methylpent-3-enoic acidSMILES: CC(=CCC(=O)O)CInChIKey: CQJHAULYLJXJNL-UHFFFAOYSA-NInChI: InChI=1S/C6H10O2/c1-5(2)3-4-6(7)8/h3H,4H2,1-2H3,(H,7,8)
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4-Methylpentanoic-d11 acidCas Number: 344298-98-2Formula: C6HD11O2 Molecular Weight: 127.23IUPAC Name: 2,2,3,3,4,5,5,5-octadeuterio-4-(trideuteriomethyl)pentanoic acidSMILES: CC(C)CCC(=O)OInChIKey: FGKJLKRYENPLQH-KUXNVAAFSA-NInChI: InChI=1S/C6H12O2/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)/i1D3,2D3,3D2,4D2,5DSynonyms: 4-Methylpentanoic acid-d11 | 4-Methylvaleric-d11 acid
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4-Methyl-2-methylenepentanoic acidCas Number: 25044-10-4 Compound CID: 168659Formula: C7H12O2 Molecular Weight: 128.169IUPAC Name: 4-methyl-2-methylidenepentanoic acidSMILES: CC(C)CC(=C)C(=O)OInChIKey: XQIHFGYUMFFCFG-UHFFFAOYSA-NInChI: InChI=1S/C7H12O2/c1-5(2)4-6(3)7(8)9/h5H,3-4H2,1-2H3,(H,8,9)
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2，3-Dimethylbutanoic acidCas Number: 14287-61-7 Compound CID: 26608Formula: C6H12O2 Molecular Weight: 116.16IUPAC Name: 2,3-dimethylbutanoic acidSMILES: CC(C)C(C)C(=O)OInChIKey: XFOASZQZPWEJAA-UHFFFAOYSA-NInChI: InChI=1S/C6H12O2/c1-4(2)5(3)6(7)8/h4-5H,1-3H3,(H,7,8)
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2-Ethyl-2-methylbutanoic acidCas Number: 19889-37-3 Compound CID: 29846Formula: C7H14O2 Molecular Weight: 130.19IUPAC Name: 2-ethyl-2-methylbutanoic acidSMILES: CCC(C)(CC)C(=O)OInChIKey: LHJPKLWGGMAUAN-UHFFFAOYSA-NInChI: InChI=1S/C7H14O2/c1-4-7(3,5-2)6(8)9/h4-5H2,1-3H3,(H,8,9)
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2-Ethyl-2-methylpentanoic acidCas Number: 5343-52-2 Compound CID: 95300Formula: C8H16O2 Molecular Weight: 144.21IUPAC Name: 2-ethyl-2-methylpentanoic acidSMILES: CCCC(C)(CC)C(=O)OInChIKey: WUWPVNVBYOKSSZ-UHFFFAOYSA-NInChI: InChI=1S/C8H16O2/c1-4-6-8(3,5-2)7(9)10/h4-6H2,1-3H3,(H,9,10)
