Cas no 39736-25-9 (Heptyl phenylacetate)
Heptyl phenylacetate structure
Product Name:Heptyl phenylacetate
CAS No:39736-25-9
MF:C15H22O2
MW:234.333984851837
CID:317308
PubChem ID:101315
Update Time:2025-04-19
Heptyl phenylacetate Chemical and Physical Properties
Names and Identifiers
-
- Heptyl phenylacetate
- heptyl 2-phenylacetate
- NSC 406420
- Phenylacetic acid heptyl ester
- UNII-F43QT54KTR
- Heptylphenyl acetate
- MFCMCQJYPOAXCB-UHFFFAOYSA-N
- HEPTYL PHENYL ACETATE
- EINECS 254-609-3
- ACETIC ACID, PHENYL-, HEPTYL ESTER
- F43QT54KTR
- (S)-(-)-1-(4-Methoxy-phenyl)-ethylamine
- NSC-406420
- Benzeneacetic acid, heptyl ester
- N-HEPTYL PHENYLACETATE
- A13167
- AI3-19339
- Q63409634
- NS00030657
- NSC406420
- 39736-25-9
- DTXSID1068198
- SCHEMBL3504146
-
- Inchi： 1S/C15H22O2/c1-2-3-4-5-9-12-17-15(16)13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3
- InChI Key： MFCMCQJYPOAXCB-UHFFFAOYSA-N
- SMILES： O(C(CC1C=CC=CC=1)=O)CCCCCCC
Computed Properties
- Exact Mass: 234.16206
- Monoisotopic Mass: 234.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 9
- Complexity: 195
- 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: 4.8
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
- LogP: 3.74270
Heptyl phenylacetate Related Literature
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
39736-25-9 (Heptyl phenylacetate) Related Products
- 4606-15-9(Benzeneacetic acid,propyl ester)
- 122-43-0(Butyl 2-phenylacetate)
- 14062-19-2(Ethyl p-Tolylacetate)
- 101-97-3(Ethyl phenylacetate)
- 102-19-2(Isopentyl 2-phenylacetate)
- 103-52-6(Phenethyl butyrate)
- 36076-26-3(1,4-Phenylenediacetic Acid Diethyl Ester)
- 40061-55-0(Ethyl m-tolylacetate)
- 5137-52-0(Pentyl phenylacetate)
- 102-20-5(2-Phenylethyl 2-Phenylacetate)
Recommended suppliers
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
