Cas no 85196-36-7 ( )
structure
Product Name:
CAS No:85196-36-7
MF:C10H22NO2
MW:188.28718328476
CID:990184
PubChem ID:411608
Update Time:2025-04-20
Chemical and Physical Properties
Names and Identifiers
-
- (2-ethoxy-2-oxoethyl)-triethylazanium
- 85196-36-7
- DTXSID70328541
- SCHEMBL21821326
- NSC-35090
- Ammonium, (carboxymethyl)triethyl-, bromide, ethyl ester
- NIOSH/BP3135400
- (Carboxymethyl)triethylammonium bromide ethyl ester
- BP31354000
- Carbethoxymethyl-triethylammonium bromide
- 2-Ethoxy-N,N,N-triethyl-2-oxoethan-1-aminium bromide
- SCHEMBL17338074
- NSC35090
-
-
- Inchi： 1S/C10H22NO2/c1-5-11(6-2,7-3)9-10(12)13-8-4/h5-9H2,1-4H3/q+1
- InChI Key： XMZQSPDXLBGLAX-UHFFFAOYSA-N
- SMILES： O(CC)C(C[N+](CC)(CC)CC)=O
Computed Properties
- Exact Mass: 188.165053945g/mol
- Monoisotopic Mass: 188.165053945g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 145
- 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: 1.7
- Topological Polar Surface Area: 26.3?2
Related Literature
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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