CAS:4242-18-6 / 5,6,7,8-tetrahydronaphthalene-1-carboxylic acid--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 4242-18-6
5,6,7,8-tetrahydronaphthalene-1-carboxylic acid

Structure
Name: 5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
Synonyms:

General Information

Product Number: 4242186

CAS Registry Number: 4242-18-6

Name:

1-Naphthalenecarboxylic acid, 5,6,7,8-tetrahydro-

1-Naphthoic acid, 5,6,7,8-tetrahydro- (6CI,7CI,8CI); 5,6,7,8-Tetrahydro-1-naphthalenecarboxylic acid; 5,6,7,8-Tetrahydro-1-naphthoic acid; 5,6,7,8-Tetrahydronaphthalen-1-carboxylic acid; NSC 44874

Chemical Formula: C11H12O2

Exact Mass: 176.08

Molecular Weight: 176.21

m/z: 176.08 (100.0%), 177.09 (12.1%), 178.09 (1.1%)

Elemental Analysis: C, 74.98; H, 6.86; O, 18.16

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)

InChIKey: GCFQXKYHWFWGSB-UHFFFAOYSA-N

Canonical SMILES : C1CCC2=C(C=CC=C2C1)C(=O)O

Thermal Properties	Value	Condition	Note
Melting Point	151-152 °C	Solv: acetic acid (64-19-7); water (7732-18-5)	(2)IC
Melting Point	148-150 °C		(4)IC
Melting Point	148-150 °C		(5)CAS
Melting Point	148-149 °C		(6)IC
Melting Point	96-97 °C		(5)CAS

Specification

98%

References

(1) Zou, Pei; Acta Crystallographica, Section E: Structure Reports Online 2009, V65(12), Po3223 CAPLUS
(2) Amin, Shantilal; Journal of Medicinal Chemistry 1979, V22(11), P1336-40 CAPLUS
(3) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
(4) Wightman, Robert H.; Journal of Organic Chemistry 1978, V43(11), P2167-70 CAPLUS
(5) Adkins, Homer; Journal of the American Chemical Society 1949, V71, P3528-31 CAPLUS
(6) Meyers, A. I.; Journal of Organic Chemistry 1981, V46(4), P783-8 CAPLUS
(7) Dauben, Wm. G.; Journal of the American Chemical Society 1951, V73, P1393-1400 CAPLUS
(8) Letsinger, Robert L.; Journal of Organic Chemistry 1960, V25, P1844-8 CAPLUS

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