Benzoic acid,2-hydroxy-, (1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-(CAS No. 560-88-3) CAS NO.560-88-3

Min.Order: 1 Gram
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Product Details

Keywords

Benzoic acid,2-hydroxy-, (1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-
560-88-3
98%

Quick Details

ProName: Benzoic acid,2-hydroxy-, (1R,2S,4R)-1,...
CasNo: 560-88-3
Molecular Formula: C17H22 O3
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: According to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram

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Details

Identification and Related Records
【Name】
Benzoic acid,2-hydroxy-, (1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-
【Iupac name】
[(1R,3R,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-hydroxybenzoate
【CAS Registry number】
560-88-3
【Synonyms】
Benzoicacid, 2-hydroxy-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-
Salicylic acid, 2-bornyl ester, endo- (8CI)
Borneol, salicylate (8CI)
Bornylsalicylate
Limosal
NSC 68014
Salit
【EINECS(EC#)】
209-213-5
【Molecular Formula】
C17H22 O3 (Products with the same molecular formula)
【Molecular Weight】
274.35
【Inchi】
InChI=1/C17H22O3/c1-16(2)11-8-9-17(16,3)14(10-11)20-15(19)12-6-4-5-7-13(12)18/h4-7,11,14,18H,8-10H2,1-3H3/t11-,14-,17-/m1/s1
【Canonical SMILES】
CC1(C2CCC1(C(C2)OC(=O)C3=CC=CC=C3O)C)C
【Isomers smiles】
C[C@]12CC[C@@H](C1(C)C)C[C@H]2OC(=O)C3=CC=CC=C3O
【MOL File】
560-88-3.mol
Chemical and Physical Properties
【Density】
1.16g/cm3
【Boiling Point】
350.3°Cat760mmHg
【Refractive Index】
1.568
【Flash Point】
136.5°C
【Computed Properties】
Molecular Weight:274.35478 [g/mol]
Molecular Formula:C17H22O3
XLogP3-AA:4.9
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:3
Tautomer Count:4
Exact Mass:274.156895
MonoIsotopic Mass:274.156895
Topological Polar Surface Area:46.5
Heavy Atom Count:20
Formal Charge:0
Complexity:403
Isotope Atom Count:0
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1

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