AG008FWF

85977-52-2 | (S)-1,2,3,4-Tetrahydronaphthoic acid

AG008FWF

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CAS Number	85977-52-2
Catalog Number	AG008FWF(AGN-PC-0OK4EM)
Chemical Name	(S)-1,2,3,4-Tetrahydronaphthoic acid
EC Number	617-787-7
IUPAC Name	(1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
InChI	InChI=1S/C11H12O2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H,12,13)/t10-/m0/s1
InChI Key	VDLWTJCSPSUGOA-JTQLQIEISA-N
MDL Number	MFCD07368365
Molecular Formula	C11H12O2
Molecular Weight	176.2118
SMILES	O=C(O)[C@H]1CCCC2=C1C=CC=C2
Synonyms	85977-52-2, (S)-1,2,3,4-tetrahydro-1-naphthoic acid, (S)-1,2,3,4-tetrahedro-naphthoic acid, (S)-1,2,3,4-tetrahydro-naphthoic acid, (1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid, MFCD07368365, (S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid, (S)-(-)-1,2,3,4-Tetrahydronaphthoic acid, Q-100994, (1S)-tetralin-1-carboxylic acid, AK-48549, PubChem11869, (S)-1, 2, 3, 4-Tetrahydronaphthoic acid, SCHEMBL2796237, CTK3E8704, KS-00000JQE, DTXSID40647519, VDLWTJCSPSUGOA-JTQLQIEISA-N, ZINC6243412, ZX-AT000863, ANW-46646, CT-217, FCH920265, OR4201, AKOS015833089, AC-6928, AN-1424, CS-W020725, EBD2198221, PS-5084, RTR-026813, (S)-1,2,3,4-Tetrahydronaphthoic acid, AJ-55987, BC226563, SC-14979, AX8022877, DB-008986, TL8005600, TR-026813, FT-0642021, ST24020778, (1S)-1,2,3,4-Tetrahydro-1-naphthoic acid, M-2681, (1S)-1-Carboxy-1,2,3,4-tetrahydronaphthalene, 977T522, C-36758, 1,2,3,4-Tetrahydronaphthalene-1beta-carboxylic acid, (S)-1,2,3,4-Tetrahydro-1-naphthoic acid, AldrichCPR, (S)-1,2,3,4-tetrahydro-naphthalene-1-carboxylic acid, 1-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-, (1S)-, (S)-(-)-1,2,3,4-Tetrahedro-naphthoic acid, ACN-040772, CB11291, - -1,2,3,4-TETRAHEDRO-NAPHTHOICACID, ?(S)-1,2,3,4-Tetrahydro-naphthalene-1-carboxylic acid, (S)-1,2,3,4-Tetrahydro-1-naphthoic acid, 98% 250mg, (S)-1,2,3,4-Tetrahydro-naphthoic acid, 98% - 1G 1g,

Complexity	200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	176.084g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.215g/mol
Monoisotopic Mass	176.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number