Cas no 56097-33-7 (Benzeneacetyl chloride, 4-(chloromethyl)-)
56097-33-7 structure
Product Name:Benzeneacetyl chloride, 4-(chloromethyl)-
CAS No:56097-33-7
MF:C9H8Cl2O
MW:203.065220832825
CID:349863
PubChem ID:20380233
Update Time:2025-04-19
Benzeneacetyl chloride, 4-(chloromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetyl chloride, 4-(chloromethyl)-
- 2-[4-(chloromethyl)phenyl]acetyl chloride
- SCHEMBL11510399
- DTXSID60606461
- WBZLWGLHESFGHD-UHFFFAOYSA-N
- 56097-33-7
- p-chloromethylphenylacetyl chloride
- [4-(Chloromethyl)phenyl]acetyl chloride
-
- Inchi： 1S/C9H8Cl2O/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5-6H2
- InChI Key： WBZLWGLHESFGHD-UHFFFAOYSA-N
- SMILES： ClCC1C=CC(=CC=1)CC(=O)Cl
Computed Properties
- Exact Mass: 201.99534
- Monoisotopic Mass: 201.9952203g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 151
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Benzeneacetyl chloride, 4-(chloromethyl)- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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