2-[(4-Benzoylphenoxy)methyl]oxirane

HCID 352816

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基本情報

CAS: 19533-07-4
標準SMILES: O=C(c1ccccc1)c1ccc(OCC2CO2)cc1
InChIKey: LJRIZGQRKVWXSI-UHFFFAOYSA-N
分子式: C16H14O3
平均分子量: 254.28 g/mol
単同位体質量: 254.09429431

名称と識別子

優先名称: 2-[(4-Benzoylphenoxy)methyl]oxirane
IUPAC: [4-(oxiran-2-ylmethoxy)phenyl]-phenylmethanone
英語名: Methanone,[4-(oxiranylmethoxy)phenyl]phenyl-
分子式: C16H14O3
分子量: 254.28

名称と別名

2-[(4-benzoylphenoxy)methyl]oxirane2-((4-benzoylphenoxy)methyl)oxiraneRefChem:448879896-678-819533-07-42-(4-benzoylphenoxymethyl)oxirane(4-(Oxiran-2-ylmethoxy)phenyl)(phenyl)methanone4-glycidyloxy benzophenone[4-(oxiran-2-ylmethoxy)phenyl]-phenylmethanone[4-(oxiran-2-ylmethoxy)phenyl](phenyl)methanoneMFCD06655031METHANONE,[4-(OXIRANYLMETHOXY)PHENYL]PHENYL-

名称をさらに表示

[4-(2-Oxiranylmethoxy)phenyl]phenylmethanoneMethanone, [4-(2-oxiranylmethoxy)phenyl]phenyl-

4-(glycidyloxy)benzophenoneNSC528176SCHEMBL1160078DTXSID10326440LJRIZGQRKVWXSI-UHFFFAOYSA-NNSC-5281764-Glycidyloxy benzophenone (Stellar-2011)DS-000209

データベース識別子

CAS: 19533-07-4
PubChem CID: 352816
DTXSID: DTXSID10326440
EC Number: 896-678-8
Nikkaji: J967.810G

物性

構造計算による物性

XLogP: 2.9
極性表面積: 38.8 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 5
重原子数: 19
形式電荷: 0
複雑度: 301

物理化学的性質

融点: 81 °C · 81 °C
沸点: 415.5 · 415.5±20.0 °C(Predicted)
比重(密度): 1.2 · 1.200±0.06 g/cm3(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.