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CAS Number: 4771-50-0
7-methyl-1H-indole-3-carbaldehyde

Structure

7-methyl-1H-indole-3-carbaldehyde
Name: 7-methyl-1H-indole-3-carbaldehyde
Synonyms:
General Information
Product Number: 4771500
CAS Number:
4771-50-0
Name:
1H-Indole-3-carboxaldehyde,7-methyl-
 Indole-3-carboxaldehyde, 7-methyl- (7CI,8CI); 7-Methyl-1H-indole-3-carboxaldehyde; 7-Methylindole-3-carboxaldehyde; NSC 91539 
Chemical Formula: C10H9NO
Exact Mass: 159.07
Molecular Weight: 159.18
m/z: 159.07 (100.0%), 160.07 (11.3%)
Elemental Analysis: C, 75.45; H, 5.70; N, 8.80; O, 10.05
Deleted CAS Registry Numbers: 866601-65-2
InChI: InChI=1S/C10H9NO/c1-7-3-2-4-9-8(6-12)5-11-10(7)9/h2-6,11H,1H3
InChIKey: KTUFZHVVJBHGKZ-UHFFFAOYSA-N
Canonical SMILES : CC1=CC=CC2=C1NC=C2C=O
 
Thermal Properties Value Condition Note
Melting Point 212-214 °C   (2)CAS
Melting Point 206-208 °C Solv: chloroform (67-66-3); ethyl acetate (141-78-6) (3)CAS
Melting Point 203-204 °C   (1)CAS
Melting Point 202 °C   (4)CAS

Specification

98%

References
  1. (1) Xu, Hui; Chemical Biology & Drug Design 2011, V78(5), P864-868 CAPLUS
  2. (2) Heath-Brown, B.; Journal of the Chemical Society 1965, (Dec.), P7165-78 CAPLUS
  3. (3) Hofmann, A.; BE 628441 1963 CAPLUS
  4. (4) Boyd, Wm J.; Biochemical Journal 1935, V29, P555-61 CAPLUS
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