2-Phenylethyl 3-methylbutyrate

  • Định danh

    Số CAS
    140-26-1

    Công thức phân tử
    C13H18O2

    SMILES
    CC(C)CC(=O)OCCC1=CC=CC=C1

    Chỉ số lưu (RI)

    • DB5: 1488.67
    • Carbowax: 1967.5

  • Hồ sơ mùi hương

    Mùi Xác xuất
    fruity 88.48%
    sweet 77.17%
    floral 76.1%
    rose 65.51%
    honey 54.81%
    apple 54.48%
    balsamic 51.51%
    green 48.38%
    apricot 45.77%
    pineapple 45.62%

  • Thuộc tính

    XLogP3-AA
    3.6 Tan tốt trong BB, DEP, MMB

    Khối lượng phân tử
    206.28 g/mol

    Nhiệt độ sôi

    • 263.00 to 264.00 °C. @ 760.00 mm Hg

    Độ tan

    • Insoluble in water; soluble in oils
    • 1 mL in 3 ml 80% ethanol (in ethanol)

  • Các tên gọi

    • 140-26-1
    • Phenethyl isovalerate
    • Phenylethyl isovalerate
    • 2-Phenylethyl 3-methylbutanoate
    • 2-Phenylethyl isovalerate
    • Butanoic acid, 3-methyl-, 2-phenylethyl ester
    • ISOVALERIC ACID, PHENETHYL ESTER
    • Phenylethyl 3-methylbutyrate
    • Phenethyl isovalerianate
    • Benzylcarbinyl isovalerate
    • 2-Phenylethyl 3-methylbutirate
    • Phenethyl 3-methylbutyrate
    • Benzylcarbinyl isopentanoate
    • phenethyl 3-methylbutanoate
    • FEMA No. 2871
    • Benzylcarbinyl 3-methylbutanoate
    • .beta.-Phenylethyl isovalerate
    • Phenethyl isovalerate (natural)
    • 2-phenylethyl isopentanoate
    • beta-Phenylethyl isovalerate
    • EINECS 205-406-3
    • UNII-K86JE60K0L
    • NSC 21899
    • Benzyl carbinyl isovalerianate
    • BRN 2504902
    • K86JE60K0L
    • Phenyl ethyl 3-methyl-butanoate
    • Phenethyl isopentanoate
    • AI3-30606
    • FEMA 2871
    • Phenylethyl iso-valerate
    • NSC-21899
    • DTXSID2059693
    • PHENETHYL ISOVALERATE [FCC]
    • 4-06-00-03074 (Beilstein Handbook Reference)
    • PHENETHYL ISOVALERATE [FHFI]
    • 3-methylbutanoic acid 2-phenylethyl ester
    • Isovaleric Acid Phenethyl Ester
    • MFCD00044322
    • 1-phenethyl isovalerate
    • I2-Phenylethyl isovalerate
    • beta -phenylethyl isovalerate
    • Phenylethyl 3-methylbutanoate
    • SCHEMBL114173
    • 2-phenylethyl 3-methylbutyrate
    • DTXCID3034539
    • NSC21899
    • 2-Phenylethyl 3-methylbutanoic acid
    • Isovaleric Acid 2-Phenylethyl Ester
    • AKOS015960577
    • 3-methylbutanoic acid phenylethyl ester
    • AS-66810
    • Phenethyl isovalerate, >=98%, FCC, FG
    • DB-042513
    • Butanoic acid,3-methyl-,2-phenylethyl ester
    • CS-0154251
    • NS00013119
    • P2009
    • E75829
    • Q11066026
    • 205-406-3
1 4

Thực vật

Tên CAS Thực vật Tỷ lệ
Shanqiu Anaphalis margaritacea (L.) Benth.et Hook.(Shanqiu),fam.Asteraceae (Comp.) 0.08%
Eucalyptus globulus (Spain) 1 8016-26-0 Eucalyptus globulus Labill., fam. Myrtaceae 0.12%
Narcissus poeticus absolute 8023-75-4 Narcissus poeticus L., fam. Amaryllidaceae 0.1%
Geranium (Egypt) 4 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 0.3%
Michelia alba flower absolute (China) Michelia alba DC., fam. Magnoliaceae 0.37%
Eucalyptus globulus (Portugal) 1 8016-26-0 Eucalyptus globulus Labill., fam. Myrtaceae 0.01%
Daphne tangutica flower concrete (China) Daphne tangutica Maxim., fam. Thymelaeaceae 0.35%
Mimusops elengi flower headspace Mimusops elengi L., fam. Sapotaceae 0.15%
Boronia megastigma 91771-36-7 Boronia megastigma Nees., fam. Rutaceae 0.05%
Eucalyptus globulus (Portugal) 2 8016-26-0 Eucalyptus globulus Labill., fam. Myrtaceae 0.2%
Pinus pinaster (Greece) needle 8000-26-8 Pinus pinaster Ait., fam. Pinaceae 1.7%
Pinus nigra ssp. laricio (Corsica) 1a Pinus nigra ssp. laricio (Poir.) Maire, fam. Pinaceae 1.3%
Pinus nigra ssp. laricio (Corsica) 1b Pinus nigra ssp. laricio (Poir.) Maire, fam. Pinaceae 0.7%
Geranium macrorrhizum (Serbia) Geranium macrorrhizum L., fam. Geraniaceae 1.6%
Libanothamus humbertii leaf (Venezuela) Libanothamus humbertii Cuatr., fam. Asteraceae (Compositae) 1.2%