4-Pentylphenyl 4-propylbenzoate

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Catalog Number
ACM50649600
Product Name
4-Pentylphenyl 4-propylbenzoate
Structure
Structure
CAS
50649-60-0
Category
Organic & Printed Electronics
Synonyms
4-propyl-benzoicaci4-pentylphenylester;Benzoicacid,4-propyl-,4-pentylphenylester;4-PENTYLPHENYL 4-PROPYLBENZOATE;4-PENTYLPHENYL 4-PROPYLBENZOATE;4-(N-PROPYL)BENZOIC ACID-4-(N-PENTYL)PHENOL ESTER;4-Pentylphenyl-4-Propylbenzoate,3.5-DaeaC21H26O2;4-n-Pentylp
IUPAC Name
(4-pentylphenyl) 4-propylbenzoate
Molecular Weight
310.4g/mol
Molecular Formula
C21H26O2
Canonical SMILES
CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCC
InChI
InChI=1S/C21H26O2/c1-3-5-6-8-18-11-15-20(16-12-18)23-21(22)19-13-9-17(7-4-2)10-14-19/h9-16H,3-8H2,1-2H3
InChI Key
WNBFPAKRCJNBBS-UHFFFAOYSA-N
Complexity
323
Covalently-Bonded Unit Count
1
EC Number
256-684-8
Exact Mass
310.19328g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
23
Monoisotopic Mass
310.19328g/mol
Rotatable Bond Count
9
XLogP3
7.1
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