(15S)-15-METHYLTETRACYCLO[8.7.0.0(2,7).0(11,15)]HEPTADECA-2,4,6-TRIENE-5,13,14-TRIOL

CAS No.
50-27-1
CCD No.
CCD05421660
Formula
C18 H24 O3
MolWeight
288.385

Basic Information

Product Name: (15S)-15-METHYLTETRACYCLO[8.7.0.0(2,7).0(11,15)]HEPTADECA-2,4,6-TRIENE-5,13,14-TRIOL
CAS: 50-27-1
English Synonyms: (15S)-15-METHYLTETRACYCLO[8.7.0.0(2,7).0(11,15)]HEPTADECA-2,4,6-TRIENE-5,13,14-TRIOL ; ESTRIOL
MDL Number.: MFCD20231425
H bond acceptor: 3
H bond donor: 3
Smile: C[C@]12CCC3c4ccc(cc4CCC3C1CC(C2O)O)O
InChi: InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13?,14?,15?,16?,17?,18-/m0/s1
InChiKey: InChIKey=PROQIPRRNZUXQM-KXGAMWBWSA-N

Property

Melting Point: 282℃

Safety information

Symbol: GHS08 GHS08
Signal word: Danger
Hazard statements: H351,H360
Precautionary statements: P201,P281,P308+P313
hazard symbol: T
Risk Code: R:R40;R60;R61;
Safe Code: S:S22;S36/37/39/;S45;S53;
WGK Germany: 3

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