Cas no 62899-71-2 (Carbamic chloride, bis(2-chloropropyl)-)
62899-71-2 structure
Product Name:Carbamic chloride, bis(2-chloropropyl)-
CAS No:62899-71-2
MF:C7H12Cl3NO
MW:232.535279273987
CID:429060
PubChem ID:23318575
Update Time:2025-04-19
Carbamic chloride, bis(2-chloropropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Carbamic chloride, bis(2-chloropropyl)-
- N,N-bis(2-chloropropyl)carbamoyl chloride
- DTXSID60632846
- 62899-71-2
- SCHEMBL10651523
- Bis(2-chloropropyl)carbamyl chloride
-
- Inchi： 1S/C7H12Cl3NO/c1-5(8)3-11(7(10)12)4-6(2)9/h5-6H,3-4H2,1-2H3
- InChI Key： CIWQGLJZYXEMFW-UHFFFAOYSA-N
- SMILES： ClC(C)CN(C(=O)Cl)CC(C)Cl
Computed Properties
- Exact Mass: 230.99866
- Monoisotopic Mass: 230.998447g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 144
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31
Carbamic chloride, bis(2-chloropropyl)- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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