Cas no 13751-83-2 (Heptanoyl chloride,2-methyl-)
Heptanoyl chloride,2-methyl- structure
Product Name:Heptanoyl chloride,2-methyl-
CAS No:13751-83-2
MF:C8H15ClO
MW:162.657101869583
CID:119894
PubChem ID:14234519
Update Time:2025-04-18
Heptanoyl chloride,2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Heptanoyl chloride,2-methyl-
- 2-METHYLHEPTANOYL CHLORIDE
- 2-Methylenanthylchloride
- 2-methyl-heptanoic acid chloride
- 2-Methyl-heptansaeure-chlorid
- Heptanoyl chloride,2-methyl
- racemic 2-methyl-enanthic acid-chloride
- Racemisches 2-Methyl-oenanthsaeure-chlorid
- 2-methylheptanoic acid chloride
- Heptanoyl chloride, 2-methyl-
- DTXSID40557780
- SCHEMBL1410433
- AKOS006280242
- 13751-83-2
- YKPOJBPJGIYSCL-UHFFFAOYSA-N
-
- Inchi： 1S/C8H15ClO/c1-3-4-5-6-7(2)8(9)10/h7H,3-6H2,1-2H3
- InChI Key： YKPOJBPJGIYSCL-UHFFFAOYSA-N
- SMILES： ClC(C(C)CCCCC)=O
Computed Properties
- Exact Mass: 162.08100
- Monoisotopic Mass: 162.0811428g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 5
- Complexity: 101
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07000
- LogP: 2.96820
Heptanoyl chloride,2-methyl- 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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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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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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