Identification
Properties
Safety Data
Specifications andamp ; Other Information
Links
Identification
CAS Number
1531-77-7
Name
Dibenz[b,e]thiepin-11(
6H)-one
Synonyms
1531-77-7 [
RN] 216-241-1 [
EINECS] 6,11-Dihydrodibenzo[b,e]thiepin-11-one Dibenz[b,e]thiepin-11(
6H)-one dibenzo(b,e)thiepin-11(6h)-one Dibenzo[b,e]thiepin-11(
6H)-on [German] [
ACD/
IUPAC Name] Dibenzo[b,e]thiepin-11(
6H)-one [
ACD/Index Name] [
ACD/
IUPAC Name] Dibenzo[b,e]thiépin-11(
6H)-one [French] [
ACD/
IUPAC Name] [1531-77-7] 1-[3-[[5-[[5-[(3,5-dihydroxy-4-methoxy-6-methyl-2-oxanyl)oxy]-4-methoxy-6-methyl-2-oxanyl]oxy]-4-methoxy-6-methyl-2-oxanyl]oxy]-8,11,12,14,16-pentahydroxy-10,13-dimethyl-1,2,3,4,7,9,11,12,15,17-decahy 11-Oxo-6,11-dihydrodibenzo(b,e).thiepin 11-Oxo-6,11-dihydrodibenzo[B,C]thiepin 11-Oxo-6,11-dihydrodibenzo[b,e]thiepin 1-Oxo-6,11-dihydrodibenzo[b,e]thiepin 6,11-Dihydrodibenzo(b,e)thiepin-11-one 6,
11-DIHYDRODIBENZO[B,E]
THIEPIN-11-ONE,97% 6H-benzo[c][1]benzothiepin-11-one 6H-dibenzo[c,f]thiepan-11-one 6H-dibenzo[c,f]thiepin-11-one
9-THIATRICYCLO[9.4.0.0,?]
PENTADECA-1(11),3,5,7,12,
14-HEXAEN-2-ONE 9-thiatricyclo[9.4.0.0?,?]pentadeca-1(15),3,5,7,11,13-hexaen-2-one
ACMC-1BUUB MFCD02093738 [
MDL number]
UNII-XO254YE73I Molecular Structure
Structure of Dibenz[b,e]thiepin-11(6H)-one CAS 1531-77-7
SMILES
c1ccc2c(c1)CSc3ccccc3C2=O
StdInChI
InChI=
1S/
C14H10OS/c15-14-11-6-2-1-5-10(11)9-16-13-8-4-3-7-12(13)14/h1-8H,
9H2 StdInChIKey
JGJDEWXZEIHBNW-UHFFFAOYSA-N Molecular Formula
C14H10OS Molecular Weight
226.294
EINECS
216-241-1
MDL Number
MFCD02093738 Properties
Appearance
Light yellow or almost white crystalline powder
Melting Point
85-87℃
Safety Data
Personal Protective Equipment
Eyeshields, Gloves, type
N95 (
US), type
P1 (
EN143) respirator filter
RIDADR
NONH for all modes of transport
WGK Germany
2
Specifications and Other Information of Our Dibenz[b,e]thiepin-11(6H)-one CAS 1531-77-7
Standard
Enterprise standard
Identification Methods
HPLC Purity
≥98%
Water
≤0.2%
Residue on Ignition
≤0.1%
Single Impurity
≤0.5%
Total Impurities
≤2.0%
Package
25kg, 50kg cardboard drum, lined with plastic bag.
Storage
Under the room temperature and away from light
Application
Commonly used in pharmaceutical intermediates, mainly used for thioglyphidated intermediates.
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