Heptanoic acid

  • Identifiers

    CAS mumber
    111-14-8

    Molecular formula
    C7H14O2

    SMILES
    CCCCCCC(=O)O

    Retention indicies (RI)

    • DB5: 1083.0
    • Carbowax: 1941.2

  • Properties

    XLogP3-AA
    2.5 Well soluble in DEP, BB, MMB

    Molecular weight
    130.18 g/mol

    Melting points

    • 16 °F (NTP, 1992)
    • -7.17 °C
    • -7.5 °C
    • -7.5 °C

    Boiling points

    • 432 to 473 °F at 760 mmHg (NTP, 1992)
    • 222.2 °C
    • 222.00 to 223.00 °C. @ 760.00 mm Hg
    • 223 °C

    Flash points

    • greater than 235 °F (NTP, 1992)
    • 110 °C (open cup) ... 118 °C (closed cup)
    • near 200 °F
    • >110 °C c.c.

    Solubilities

    • 1 to 10 mg/mL at 73 °F (NTP, 1992)
    • Solubility in water = 0.2419 g/100 mL water at 15 °C; soluble in ethanol, ether, DMF, dimethyl sulfoxide.
    • SOL IN ACETONE, NITRIC ACID
    • Slightyl soluble in carbon tetrachloride; soluble in acetone
    • In water, 2.82X10+3 mg/L at 25 °C
    • 2.82 mg/mL
    • Solubility in water, g/100ml at 15 °C: 0.242
    • slightly soluble in water; soluble in alcohol, ether, acetone, nitric acid, and dimethyl sulfoxide

  • Synonyms

    • HEPTANOIC ACID
    • 111-14-8
    • Enanthic acid
    • n-Heptanoic acid
    • Oenanthic acid
    • Enanthylic acid
    • Heptoic acid
    • n-Heptylic acid
    • n-Heptoic acid
    • Heptylic acid
    • Oenanthylic acid
    • 1-Hexanecarboxylic acid
    • Hexacid C-7
    • FEMA No. 3348
    • Heptanoic acid (natural)
    • NSC 2192
    • CCRIS 6042
    • enanthoic acid
    • Hepthlic acid
    • HSDB 5546
    • UNII-THE3YNP39D
    • THE3YNP39D
    • EINECS 203-838-7
    • MFCD00004426
    • Technetium Medronate
    • BRN 1744723
    • Heptanoic--d7 Acid
    • DTXSID2021600
    • CHEBI:45571
    • AI3-02073
    • Artec ultra conditioning teat dip
    • HEPTANOIC AICD-
    • NSC-2192
    • DTXCID301600
    • HEPTANOIC-2,2-D2 ACID
    • NSC2192
    • EC 203-838-7
    • 4-02-00-00958 (Beilstein Handbook Reference)
    • C7:0
    • HEPTANOIC-5,5,6,6-D4 ACID
    • Heptanoic Acid Anion
    • sec-Heptanoic acid
    • 101488-09-9
    • ENANTHIC ACID (USP-RS)
    • ENANTHIC ACID [USP-RS]
    • 1219802-86-4
    • CAS-111-14-8
    • SHV
    • 352431-36-8
    • TESTOSTERONE ENANTATE IMPURITY A (EP IMPURITY)
    • TESTOSTERONE ENANTATE IMPURITY A [EP IMPURITY]
    • Heptansaeure
    • Oenanthsaeure
    • Cynergy
    • Hexacid
    • heptanoic-acid
    • Artec
    • WinterCare
    • Cynergy Barrier
    • Winter Dip
    • 1-heptanoic acid
    • Chem-Star Recover
    • Acid C7 heptanoic
    • DKL
    • hexane carboxylic acid
    • Chem-Star Code Green
    • Heptanoic acid, 96%
    • hexane-1-carboxylic acid
    • Chem-Star Barrier 710
    • Heptanoic acid, >=97%
    • SCHEMBL3564
    • WLN: QV6
    • 5-HEXACID C-7
    • HEPTANOIC ACID [MI]
    • NCIOpen2_005395
    • Heptanoic acid, 97%, FG
    • Heptanoic acid, natural, FG
    • MLS002415755
    • CH3-(CH2)5-COOH
    • HEPTANOIC ACID [FHFI]
    • HEPTANOIC ACID [HSDB]
    • CHEMBL320358
    • HMS2267D15
    • Heptanoic acid, analytical standard
    • Tox21_201830
    • Tox21_300342
    • FA 7:0
    • Heptanoic acid, >=98.0% (GC)
    • Heptanoic acid, >=99.0% (GC)
    • LMFA01010007
    • STL481898
    • AKOS000119950
    • DB02938
    • FH33951
    • HEPTANOIC ACID (ENANTIC ACID)
    • NCGC00091189-01
    • NCGC00091189-02
    • NCGC00091189-03
    • NCGC00254267-01
    • NCGC00259379-01
    • SMR001261667
    • H0030
    • NS00010236
    • EN300-19601
    • C17714
    • Q297592
    • E3F2CC4A-F2B5-4353-8922-355FA750FEAC
    • F0001-0233
    • Z104474412
    • Enanthic Acid, United States Pharmacopeia (USP) Reference Standard
    • InChI=1/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9
    • 203-838-7
1 3

Botanical

Name CAS Botanical Proportion
Blackcurrant bud 1 68606-81-5 Ribes nigrum L., fam. Grossulariaceae 0.01%
Hedychium coronarium flower (Japan) Hedychium coronarium Koenig, fam. Zingiberaceae 0.03%
Osmanthus concentrate 1 (Sukhumi-Abkhasia) 68917-05-5 Osmanthus fragrans (Thunb.) Lour., fam. Oleaceae 0.13%
Genet absolute 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.03%
Zizyphus jujuba fruit (Malaysia) Zizyphus jujuba Mill. var. inermis, fam. Rhamnaceae 1.55%
Fenugreek 1b steamdistillate 84625-40-1 Trigonella foenum-graecum L., fam. Leguminosae 2.5%
Fenugreek 1c extract 84625-40-1 Trigonella foenum-graecum L., fam. Leguminosae 7.5%
Spearmint, scotch (Japan) Mentha gracilis Sole, fam. Lamiaceae (Labiatae) 0.37%
Genipap fruit (Brazil) Genipa americana L., fam. Rubiaceae 4.5%
Carob bean powder 2a raw 9000-40-2 Ceratonia siliqua L., fam. Leguminoseae 0.1%
Carob bean powder 2b roasted 9000-40-2 Ceratonia siliqua L., fam. Leguminoseae 0.1%
Dialium guineense fruit Dialium guineense Wild., fam. Cesalpinaceae 2.2%
Pineapple pulp Ananas comosus (L.) Merr., fam. Bromeliaceae 0.03%
Leea guineensis (Cameroon) 1a wood Leea guineensis G. Don, fam. Leeaceae 0.4%
Cassie absolute 1a extract 8023-82-3 Acacia farnesiana (L.) Willd., fam. Mimosaceae (Leguminosae) 0.5%