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2-[[(1R)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid

Catalog No: FT-0770919

CAS No: 163438-05-9

Chemical Name: 2-[[(1R)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid
Molecular Formula: C20H17NO3
Molecular Weight: 319.4
InChI Key: ZEKKAEAOTSMLNW-CYBMUJFWSA-N
InChI: InChI=1S/C20H17NO3/c1-13(15-12-6-8-14-7-2-3-9-16(14)15)21-19(22)17-10-4-5-11-18(17)20(23)24/h2-13H,1H3,(H,21,22)(H,23,24)/t13-/m1/s1

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

CAS:	163438-05-9
MF:	C20H17NO3
Density:	1.255g/cm3
Flash_Point:	305.8ºC
Melting_Point:	166ºC (dec.)(lit.)
Product_Name:	2-[[(1R)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid
Symbol:	GHS07
Bolling_Point:	582ºC at 760mmHg
FW:	319.35400

MF:	C20H17NO3
Density:	1.255g/cm3
Computational_Chemistry:	['1 . XlogP 39 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 664 ', '7 . Heavy Atom Count 24 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 464 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 1 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
More_Info:	['1 . Appearance Solid ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）166 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,011hPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）[α]26/D −48°, c = 1甲醇 ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']
Exact_Mass:	319.12100
Vapor_Pressure:	2.18E-14mmHg at 25°C
Flash_Point:	305.8ºC
PSA:	69.89000
LogP:	4.60380
Bolling_Point:	582ºC at 760mmHg
FW:	319.35400
Refractive_Index:	1.658
Melting_Point:	166ºC (dec.)(lit.)

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Symbol:	GHS07
Safety_Statements:	S26
Warning_Statement:	P261-P305 + P351 + P338
Hazard_Codes:	Xi: Irritant;
Risk_Statements(EU):	R36/37/38
RIDADR:	NONH for all modes of transport