Cas no 3187-26-6 (4,4-bis(2-chloroethyl)-1-methylpiperidine;hydrochloride)
3187-26-6 structure
Product Name:4,4-bis(2-chloroethyl)-1-methylpiperidine;hydrochloride
CAS No:3187-26-6
MF:C10H20Cl3N
MW:260.631500244141
CID:1453083
PubChem ID:24187148
Update Time:2025-04-20
4,4-bis(2-chloroethyl)-1-methylpiperidine;hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 4,4-bis(2-chloroethyl)-1-methylpiperidine,hydrochloride
- 4,4-bis(2-chloroethyl)-1-methylpiperidine
- hydrochloride
- DTXSID20637337
- NSC59970
- 3187-26-6
- NSC-59970
- 4,4-Bis(2-chloroethyl)-1-methylpiperidine--hydrogen chloride (1/1)
- 4,4-bis(2-chloroethyl)-1-methylpiperidine;hydrochloride
-
- Inchi： 1S/C10H19Cl2N.ClH/c1-13-8-4-10(2-6-11,3-7-12)5-9-13;/h2-9H2,1H3;1H
- InChI Key： PRLGTRPEUUQOGM-UHFFFAOYSA-N
- SMILES： ClCCC1(CCCl)CCN(C)CC1.Cl
Computed Properties
- Exact Mass: 223.08967
- Monoisotopic Mass: 259.066
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 134
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 3.2A^2
Experimental Properties
- Density: 1.048
- Boiling Point: 282.3°C at 760 mmHg
- Flash Point: 124.5°C
- Refractive Index: 1.469
- PSA: 3.24
4,4-bis(2-chloroethyl)-1-methylpiperidine;hydrochloride Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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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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