Home > Products > Pharmaceuticals & Life Science > Pharmaceutical Intermediates > (S)-3-(5-OXO-2-(TRIFLUOROMETHYL)-1,4,5,6,7,8-HEXAHYDROQUINOLIN-4-YL)BENZONITRILE

(S)-3-(5-OXO-2-(TRIFLUOROMETHYL)-1,4,5,6,7,8-HEXAHYDROQUINOLIN-4-YL)BENZONITRILE

Name: (S)-3-(5-OXO-2-(TRIFLUOROMETHYL)-1,4,5,6,7,8-HEXAHYDROQUINOLIN-4-YL)BENZONITRILE
Brand: 2A Biotech
SKU: 2A-0101490

CAS Number172649-40-0

Synonymszd0947

Molecular FormulaC17H13F3N2O

Molecular Weight318.29

Purity≥98 (HPLC)%

Density1.365g/cm3

Boiling Point420.402ºC at 760 mmHg

Appearancepowder

EINECS0

Cat. No.: 2A-0101490 Purity: ≥98 (HPLC)%

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Quality Control of [ 172649-40-0 ] Purity: ≥98 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number	172649-40-0
Catalog No.	2A-0101490
Chinese Name	3-[(4S)-5-氧代-2-(三氟甲基)-1,4,5,6,7,8-六氢喹啉-4-基]苯甲腈
Synonyms	zd0947
Molecular Formula	C17H13F3N2O
Molecular Weight	318.29
Purity	≥98 (HPLC)
Density	1.365g/cm3
Boiling Point	420.402ºC at 760 mmHg
Appearance	powder
EINECS	0
HTC	2933499090
UN(IATA)	0
MDL Number	MFCD00944017
SMILES	O=C1C2=C(NC(C(F)(F)F)=C[C@H]2C3=CC(C#N)=CC=C3)CCC1
InChI	1S/C17H13F3N2O/c18-17(19,20)15-8-12(11-4-1-3-10(7-11)9-21)16-13(22-15)5-2-6-14(16)23/h1,3-4,7-8,12,22H,2,5-6H2/t12-/m0/s1
InChI Key	RUVMMEREJMHLOS-LBPRGKRZSA-N
NACRES Code	NA.77
UNSPSC	12352200
MSDS	msds/101490_1_172649_40_0.pdf
Use of	ZD-0947, also known as AZD-0947, is a K(ATP) channel activator potentially for the treatment of overactive bladder (OAB). Properties Name 3-[(4S)-5-oxo-2-(trifluoromethyl)-4,6,7,8-tetrahydro-1H-quinolin-4-yl]benzonitrile Synonym More Synonyms Chemical & Physical Properties Molecular Formula C17H13F3N2O Exact Mass 318.09800 PSA 52.89000 LogP 4.02718 Index of Refraction 1.573 InChIKey RUVMMEREJMHLOS-LBPRGKRZSA-N Safety Information HS Code 2933499090
Tax Rebate	13.0%
Supervision	None. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport Info	Product name: Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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