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I1308

Sigma-Aldrich

10,11-Dihydro-5H-dibenz[b,f]azepine

97%

Synonym(s):

Iminodibenzyl

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About This Item

Empirical Formula (Hill Notation):
C14H13N
CAS Number:
494-19-9
Molecular Weight:
195.26
Beilstein:
152732
EC Number:
207-787-1
MDL number:
MFCD00005070
UNSPSC Code:
12352100
PubChem Substance ID:
24895929
NACRES:
NA.22

Quality Level

200

Assay

97%

mp

105-108 °C (lit.)

SMILES string

C1Cc2ccccc2Nc3ccccc13

InChI

1S/C14H13N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-8,15H,9-10H2

InChI key

ZSMRRZONCYIFNB-UHFFFAOYSA-N

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H317

Precautionary Statements

P280

Hazard Classifications

Skin Sens. 1

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKCP8102
MKCL6917
MKCJ3524
MKCH9128
MKBX9677V

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Johannes Kornhuber et al.
European journal of medicinal chemistry, 44(6), 2667-2672 (2009-01-16)
We developed a structure-property-activity relationship (SPAR)-model for psychopharmacological drugs acting as non-competitive 5-HT(3A) receptor antagonists by using a decision-tree learner provided by the RapidMiner machine learning tool. A single molecular descriptor, namely the molecular dipole moment per molecular weight (mu/MW)
Yulia Kaluzhny et al.
Alternatives to laboratory animals : ATLA, 43(2), 101-127 (2015-05-23)
The 7th Amendment to the EU Cosmetics Directive and the EU REACH Regulation have reinforced the need for in vitro ocular test methods. Validated in vitro ocular toxicity tests that can predict the human response to chemicals, cosmetics and other

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