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 Quantity:: 1 Gram

Purity:: 99%

Port:: SHANGHAI

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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