1H-Benzo[g]indole-3-carboxaldehyde - CAS 51136-18-6
Catalog: |
BB027345 |
Product Name: |
1H-Benzo[g]indole-3-carboxaldehyde |
CAS: |
51136-18-6 |
Synonyms: |
1H-benzo[g]indole-3-carbaldehyde |
IUPAC Name: | 1H-benzo[g]indole-3-carbaldehyde |
Description: | 1H-Benzo[g]indole-3-carboxaldehyde (CAS# 51136-18-6 ) is a useful research chemical. |
Molecular Weight: | 195.22 |
Molecular Formula: | C13H9NO |
Canonical SMILES: | C1=CC=C2C(=C1)C=CC3=C2NC=C3C=O |
InChI: | InChI=1S/C13H9NO/c15-8-10-7-14-13-11-4-2-1-3-9(11)5-6-12(10)13/h1-8,14H |
InChI Key: | NYIGHGXJJVOYCQ-UHFFFAOYSA-N |
Boiling Point: | 443.8 ℃ at 760 mmHg |
Melting Point: | 231-236 ℃ |
Purity: | 95 % |
Density: | 1.322 g/cm3 |
Appearance: | White to tan solid |
MDL: | MFCD00985058 |
LogP: | 3.13360 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
WO-2011127933-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
US-2009124634-A1 | Novel dipodazine compounds and applications | 20050610 |
US-2002022626-A1 | Indolinone combinatorial libraries and related products and methods for the treatment of disease | 19970820 |
US-2003108946-A1 | Indolinone combinatorial libraries and related products and methods for the treatment of disease | 19970820 |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.068413911 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.068413911 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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