Phenylacetonitrile

  • Định danh

    Số CAS
    140-29-4

    Công thức phân tử
    C8H7N

    SMILES
    C1=CC=C(C=C1)CC#N

    Chỉ số lưu (RI)

    • DB5: 1136.67
    • Carbowax: 1894.0

  • Thuộc tính

    XLogP3-AA
    1.6 Tan tốt trong DEP, MMB, TEC

    Khối lượng phân tử
    117.15 g/mol

    Nhiệt độ tan chảy

    • -10.8 °F (EPA, 1998)
    • -23.8 °C
    • -23.8 °C

    Nhiệt độ sôi

    • 451.4 °F at 760 mmHg (EPA, 1998)
    • 233.5 °C
    • 233.00 to 234.00 °C. @ 760.00 mm Hg

    Nhiệt độ chớp cháy

    • 215 °F (NTP, 1992)
    • 102 °C
    • 102 °C (closed cup)
    • 235 °F (113 °C) (Open cup)

    Độ tan

    • less than 1 mg/mL at 63 °F (NTP, 1992)
    • Miscible with oxygenated solvents.
    • SOL IN ALL PROP IN ALC, ETHER; SOL IN ACETONE
    • In water, 100 mg/L at 25 °C
    • 0.1 mg/mL at 25 °C

  • Các tên gọi

    • Phenylacetonitrile
    • Benzeneacetonitrile
    • 2-Phenylacetonitrile
    • BENZYL CYANIDE
    • 140-29-4
    • alpha-Tolunitrile
    • Benzyl nitrile
    • alpha-Cyanotoluene
    • (Cyanomethyl)benzene
    • Phenyl acetyl nitrile
    • Benzylnitrile
    • Acetonitrile, phenyl-
    • benzylcyanide
    • Benzylkyanid
    • Phenyl-acetonitrile
    • USAF KF-21
    • Toluene, alpha-cyano-
    • Acetic acid, phenyl-nitrile
    • 2-phenylethanenitrile
    • .omega.-Cyanotoluene
    • CCRIS 4698
    • NSC 118418
    • Phenacetonitrile
    • HSDB 2103
    • Phenylacetonitrile, liquid
    • omega-Cyanotoluene
    • EINECS 205-410-5
    • .alpha.-Tolunitrile
    • UNII-23G40PRP93
    • .alpha.-Cyanotoluene
    • 2-phenyl-acetonitrile
    • DTXSID2021492
    • AI3-04975
    • 23G40PRP93
    • Toluene, .alpha.-cyano-
    • NSC-118418
    • BENZYL CYANIDE-13C
    • DTXCID401492
    • CHEBI:25979
    • BENZYL-ALPHA-13C CYANIDE
    • EC 205-410-5
    • PHENYLACETONITRILE-2,2-D2
    • MFCD00001894
    • BENZYL-D7 CYANIDE, 98 ATOM % D
    • WLN: NC1R
    • Benzylkyanid [Czech]
    • TRIAMTERENE IMPURITY D (EP IMPURITY)
    • TRIAMTERENE IMPURITY D [EP IMPURITY]
    • UN2470
    • enzylcyanide
    • phenylacetonitile
    • phenylacteonitrile
    • Cyanophenylmethane
    • alpha -cyano-
    • alpha -tolunitrile
    • phenyl acetonitrile
    • BnCN
    • alpha -cyanotoluene
    • benzene acetonitrile
    • benzene-acetonitrile
    • alpha-Cyano-Toluene
    • Benzeneacetonitrile-d5
    • alpha-phenylacetonitrile
    • Benzyl cyanide, 98%
    • Toluene, alpha -cyano-
    • Benzeneacetonitrile, 9CI
    • Benzyl cyanide, >=99%
    • Phenylacetonitrile, liquid [UN2470] [Poison]
    • BENZYL CYANIDE [MI]
    • SCHEMBL37831
    • BENZYL CYANIDE [HSDB]
    • laquo Omegaraquo -cyanotoluene
    • CHEMBL3560735
    • NSC3407
    • Benzyl cyanide, analytical standard
    • NSC-3407
    • Phenylacetonitrile (Benzyl Cyanide)
    • QCA53826
    • VCA02636
    • Tox21_200217
    • NSC118418
    • STL199233
    • AKOS000118943
    • UN 2470
    • NCGC00090854-01
    • NCGC00090854-02
    • NCGC00257771-01
    • CAS-140-29-4
    • DB-004016
    • NS00009919
    • P0128
    • Phenylacetonitrile, liquid [UN2470] [Poison]
    • A807640
    • Q425620
    • InChI=1/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H
    • 205-410-5
1 3

Thực vật

Tên CAS Thực vật Tỷ lệ
Genet headspace 1 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 5.2%
False acacia headspace (Black locust) Robinia pseudoacacia L. (False acacia) (Black locust), fam. Leguminosae 2.5%
Genet absolute 1 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.23%
Honeysuckle headspace Lonicera caprifoleum L., fam. Caprifoliaceae 0.1%
Michelia champaca flower absolute Michelia champaca L., fam. Magnoliaceae 1.3%
Osmanthus absolute 68917-05-5 Osmanthus fragrans (Thunb.) Lour., fam. Oleaceae 0.03%
Hedychium coronarium flower (Japan) Hedychium coronarium Koenig, fam. Zingiberaceae 0.69%
Narcissus poeticus absolute 8023-75-4 Narcissus poeticus L., fam. Amaryllidaceae 0.1%
Mustard, flowers 8007-40-7 Brassica juncea (L.) Czern. et Coss., fam. Brassicaceae (Crucifereae) 3.0%
Mustard, leaves & stems 8007-40-7 Brassica juncea (L.) Czern. et Coss., fam. Brassicaceae (Crucifereae) 1.1%
Mustard, root 8007-40-7 Brassica juncea (L.) Czern. et Coss., fam. Brassicaceae (Crucifereae) 0.05%
Mustard seed (China) 1 8007-40-7 Brassica juncea (L.) Czern. et Coss., fam. Brassicaceae (Crucifereae) 0.97%
Daylily, Headspace Living Flower 2 Hemerocallis, ssp. Satin Glass, fam. Liliaceae 18.42%
Hyacinth, picked flower headspace 1b Hyacinthus orientalis L., fam. Liliaceae 0.02%
Artemisia macrocephala (China) Artemisia macrocephala Jacq. ex Bess., fam. Asteraceae (Compositae) 2.99%
Genet headspace 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 2.0%
Hedychium coronarium flower headspace (China) Hedychium coronarium Koenig, fam. Zingiberaceae 0.37%
Aglaia duperreana flower (China) Aglaia duperreana Pierre, fam. Meliaceae 0.2%
Lily-of-the-valley flower headspace Convallaria majalis L., fam. Liliaceae (Convallariaceae) 3.04%
Jasmine polyanthum flower headspace Jasminum polyanthum L., fam. Oleaceae 3.36%
Jasmine azoricum concrete Jasminum azoricum L., fam. Oleaceae 0.7%
Jasmine sambac (France) concrete Jasminum sambac (L.) Aiton, fam. Oleaceae 2.7%
Acacia confusa flower (China) Acacia confusa Merr., fam. Mimosaceae (Leguminosae) 0.11%
Lemon flower headspace (clone ZH) 84929-31-7 Citrus limon (L.) Burm. f., fam. Rutaceae 17.6%
Narcissus tazetta (var. chinensis) 8023-75-4 Narcissus tazetta L., var. chinensis, fam. Amaryllidaceae 0.18%
Narcissus tazetta (var. chinensis) headspace 8023-75-4 Narcissus tazetta L., var. chinensis, fam. Amarillidaceae 0.01%
Neroli bigarade (bitter orange flower) Morocco 8016-38-4 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.67%
Bitter orange flower water absolute 2 8030-28-2 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 2.5%
Bitter orange flower absolute 2 8030-28-2 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.7%
Tulip sylvestre Tulipa sylvestris L., fam. Liliaceae 0.69%
Premna serratifolia flower bud Premna serratifolia L. (P.obtusifolia Br.R., P.taitensis Sch.),Verbenaceae 0.1%
Couroupita guianensis flower (Brazil) Couroupita guainensis Auble., fam. Lecythidaceae 0.6%
Mullilam leaf (India) Zanthoxylum rhetsa D.C. syn. Z. limonella (Dennst.) Alston, fam. Rutaceae 0.01%
Shadberry fruit Amelanchier arborea Nutt., fam. Rosaceae 0.1%
Salvadora persica root Salvadora persica L., fam. Salvadoraceae 0.4%
Parsnip flower, headspace 90082-39-6 Pastinaca sativa L., fam. Apiaceae (Umbelliferae) 0.05%
Geneps fruit (Cuba) Melicocca bijuga L., fam. Sapindaceae 0.1%