Cas no 834880-24-9 (Benzene, 2,4-bis(chloromethyl)-1-(2-propynyloxy)-)
834880-24-9 structure
Product Name:Benzene, 2,4-bis(chloromethyl)-1-(2-propynyloxy)-
CAS No:834880-24-9
MF:C11H10Cl2O
MW:229.102501392365
CID:670930
PubChem ID:71415371
Update Time:2025-04-19
Benzene, 2,4-bis(chloromethyl)-1-(2-propynyloxy)- Chemical and Physical Properties
Names and Identifiers
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- Benzene, 2,4-bis(chloromethyl)-1-(2-propynyloxy)-
- 2,4-bis(chloromethyl)-1-prop-2-ynoxybenzene
- 2,4-Bis(chloromethyl)-1-[(prop-2-yn-1-yl)oxy]benzene
- DTXSID00834786
- 834880-24-9
-
- Inchi： 1S/C11H10Cl2O/c1-2-5-14-11-4-3-9(7-12)6-10(11)8-13/h1,3-4,6H,5,7-8H2
- InChI Key： IKOHAAYBVZCINH-UHFFFAOYSA-N
- SMILES： ClCC1C=C(CCl)C=CC=1OCC#C
Computed Properties
- Exact Mass: 228.0108703g/mol
- Monoisotopic Mass: 228.0108703g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 209
- 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: 9.2?2
Benzene, 2,4-bis(chloromethyl)-1-(2-propynyloxy)- Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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