(2S-CIS)-(+)-2,3-DIHYDRO-3-HYDROXY-2-(4-METHOXYPHENYL)-1,5-BENZOTHIAZEPIN-4(5H)-ONE

CAS No.
27068-88-8 ;42399-49-5
CCD No.
CCD00214040
Formula
C16 H15 N O3 S
MolWeight
301.365

Basic Information

Product Name: (2S-CIS)-(+)-2,3-DIHYDRO-3-HYDROXY-2-(4-METHOXYPHENYL)-1,5-BENZOTHIAZEPIN-4(5H)-ONE
CAS: 27068-88-8 ;42399-49-5
English Synonyms: (2S-CIS)-(+)-2,3-DIHYDRO-3-HYDROXY-2-(4-METHOXYPHENYL)-1,5-BENZOTHIAZEPIN-4(5H)-ONE ; (2S,3S)-3-HYDROXY-2-(4-METHOXY-PHENYL)-2,3-DIHYDRO-5H-BENZO[B][1,4]THIAZEPIN-4-ONE ; CIS-LACTAM ; HYDROXY LACTAM ; (2S,3S)-(+)-2,3-DIHYDRO-3-HYDROXY-2-(4-METHOXYPHENYL)-1,5-BENZOTHIAZEPIN-4(5H)-ONE
MDL Number.: MFCD01321316
H bond acceptor: 4
H bond donor: 2
Smile: COc1ccc(cc1)[C@H]2[C@H](C(=O)Nc3ccccc3S2)O
InChi: InChI=1S/C16H15NO3S/c1-20-11-8-6-10(7-9-11)15-14(18)16(19)17-12-4-2-3-5-13(12)21-15/h2-9,14-15,18H,1H3,(H,17,19)/t14-,15+/m1/s1
InChiKey: InChIKey=LHBHZALHFIQJGJ-CABCVRRESA-N

Property

Melting Point: 203-206 DEG C(LIT)
Comments: OPTICAL ACTIVITY: [ALPHA]20/D +112 DEG, C = 0.5 IN METHANOL
UNSPSC: 12352100
WGK: 3

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H315-H319-H335
Precautionary statements: P261-P305 + P351 + P338
hazard symbol: Xi
Risk Code: R:36/37/38
Safe Code: S:26-36
WGK Germany: 3

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