AG003M9B

4242-18-6 | 5,6,7,8-Tetrahydronaphthalene-1-carboxylic acid

AG003M9B

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CAS Number	4242-18-6
Catalog Number	AG003M9B(AGN-PC-0WAAX0)
Chemical Name	5,6,7,8-Tetrahydronaphthalene-1-carboxylic acid
IUPAC Name	5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
InChI	InChI=1S/C11H12O2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2,(H,12,13)
InChI Key	GCFQXKYHWFWGSB-UHFFFAOYSA-N
MDL Number	MFCD01464030
Molecular Formula	C11H12O2
Molecular Weight	176.2118
NSC Number	44874
SMILES	C1=C(C2=C(C=C1)CCCC2)C(=O)O
Synonyms	5,6,7,8-tetrahydronaphthalene-1-carboxylic acid, 4242-18-6, 5,6,7,8-Tetrahydro-1-naphthalenecarboxylic acid, NSC44874, 1-Naphthoic acid, 5,6,7,8-tetrahydro-, GCFQXKYHWFWGSB-UHFFFAOYSA-N, 5,6,7,8-TETRAHYDRO-1-NAPHTHOIC ACID, 5,6,7,8-Tetrahydro-1-naphthalenecarboxylicacid, 5,6,7,8-tetrahydro-naphthalene-1-carboxylic acid, 5,6,7,8-tetrahydronaphthalenecarboxylic acid, 5,6,7,8-tetrahydro-1-naphtoic acid, 5.6.7.8-tetrahydro-1-naphtoic acid, tetralin-5-carboxylic acid, AC1Q5U4G, 5,6,7,8-Tetrahydronaphthalene-1-carboxylicacid, ACMC-1CT16, Oprea1_084710, KSC174G4B, SCHEMBL783869, 1-Naphthalenecarboxylic acid, 5,6,7,8-tetrahydro-, AC1L63G1, DTXSID90286336, ACT03073, BCP08830, CS-D0710, KS-00000CX4, ZINC3848335, AC-776, ANW-75272, CT-257, MFCD01464030, NSC-44874, SBB053486, 1-Naphthoic acid,6,7,8-tetrahydro-, 5,6,7,8-Terahydro-1-naphtoic acid, AKOS004907989, 1,2,3,4-tetrahydro-5-naphthoic acid, AB09150, FS-2578, RP23788, TRA0022731, TRA0053418, TRA0073072, NSC-44874 pound>>NSC 44874, AJ-45879, AK-27346, AN-15560, BC220463, BR-27346, Q110, SC-17207, SY025659, AB0017405, DB-008999, ST2411624, TR-016616, FT-0635187, ST50949663, MFCD01464030 (97%), 5,6,7,8-tetrahydronaphthalene carboxylic acid, M-2685, 1-Naphthalenecarboxylic acid,6,7,8-tetrahydro-, 242T186, 5,6,7,8-tetrahydro-1-naphthalene carboxylic acid, AE-562/12222884, 5,6,7,8-Tetrahydro-1-naphthalenecarboxylic acid #, I04-0034, J-516498, Z1741972978, 5,6,7,8-tetrahydronaphthalene-1-carboxylic acid, AldrichCPR, 1-NAPHTHOIC ACID, C11H12O2, 1,2,3,4-Tetrahydro-1-naphthoic acid, AR-1G6063, CID239604, ACN-031739, Cis-4-Phenylthio-L-proline hydrochloride, T2672, 54186-68-4, 5654-93-3,

Complexity	200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
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	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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