Cas no 14518-67-3 (Benzoic acid, 4-(2-phenylethyl)-, methyl ester)
14518-67-3 structure
Product Name:Benzoic acid, 4-(2-phenylethyl)-, methyl ester
CAS No:14518-67-3
MF:C16H16O2
MW:240.297044754028
CID:1314705
PubChem ID:20466534
Update Time:2025-04-20
Benzoic acid, 4-(2-phenylethyl)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 4-(2-phenylethyl)-, methyl ester
- BENZOIC ACID,4-(2-PHENYLETHYL)-,METHYL ESTER
- 4-Phenethyl-benzoic acid methyl ester
- WNJSVZMCJSUBOU-UHFFFAOYSA-N
- methyl 4-(2-phenylethyl)benzoate
- SCHEMBL1928912
- 14518-67-3
-
- Inchi： 1S/C16H16O2/c1-18-16(17)15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3
- InChI Key： WNJSVZMCJSUBOU-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=CC(=CC=1)CCC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 240.115
- Monoisotopic Mass: 240.115
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 248
- 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: 4.6
- Topological Polar Surface Area: 26.3A^2
Benzoic acid, 4-(2-phenylethyl)-, methyl ester Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
14518-67-3 (Benzoic acid, 4-(2-phenylethyl)-, methyl ester) Related Products
- 148438-03-3(Methyl 4-cyclopropylbenzoate)
- 123910-88-3(4-(4-Hydroxybutyl)benzoic Acid Methyl Ester)
- 98092-75-2(Benzoic acid, 4-(3-hydroxypropyl)-, ethyl ester)
- 17745-40-3(Methyl 4-Propionylbenzoate)
- 23450-30-8(Benzoic acid,4-(phenylmethyl)-, methyl ester)
- 20651-69-8(Methyl 4-Butylbenzoate)
- 22744-50-9(4-(2-Oxo-propyl)-benzoic Acid methyl ester)
- 54256-51-8(Methyl 4-octylbenzoate)
- 7364-20-7(Methyl 4-Ethylbenzoate)
- 785-79-5(4-(2-phenylethyl)benzoic acid)
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