-
Name
6-Bromovanillin
- EINECS
- CAS No. 60632-40-8
- Article Data11
- CAS DataBase
- Density 1.653 g/cm3
- Solubility
- Melting Point 178 °C
- Formula C8H7BrO3
- Boiling Point 326.2 °C at 760 mmHg
- Molecular Weight 231.046
- Flash Point 151.1 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols Xi
- Synonyms Vanillin,6-bromo- (6CI);2-Bromo-4-hydroxy-5-methoxybenzaldehyde;6-Bromovanillin;
- PSA 46.53000
- LogP 1.97580
6-Bromovanillin Chemical Properties
Product Name: Benzaldehyde,2-bromo-4-hydroxy-5-methoxy- (CAS NO.60632-40-8)
Molecular Formula: C8H7BrO3
Molecular Weight: 231.05g/mol
Mol File: 60632-40-8.mol
Index of Refraction: 1.622
Molar Refractivity: 49.25 cm3
Molar Volume: 139.7 cm3
Surface Tension: 51.6 dyne/cm
Density: 1.653 g/cm3
Flash Point: 151.1 °C
Enthalpy of Vaporization: 59.1 kJ/mol
Boiling Point: 326.2 °C at 760 mmHg
Vapour Pressure: 0.000115 mmHg at 25°C
XLogP3-AA: 1.7
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of Benzaldehyde,2-bromo-4-hydroxy-5-methoxy- (CAS NO.60632-40-8):
IUPAC Name: 2-bromo-4-hydroxy-5-methoxybenzaldehyde
Canonical SMILES: COC1=C(C=C(C(=C1)C=O)Br)O
InChI: InChI=1S/C8H7BrO3/c1-12-8-2-5(4-10)6(9)3-7(8)11/h2-4,11H,1H3
InChIKey: FVNRNBGSHCWQPD-UHFFFAOYSA-N
Product Categories: Aromatic Aldehydes & Derivatives (substituted); API intermediates
6-Bromovanillin Safety Profile
Safety Information of Benzaldehyde,2-bromo-4-hydroxy-5-methoxy- (CAS NO.60632-40-8):
Hazard Codes: Xi
HazardClass: IRRITANT
6-Bromovanillin Specification
Benzaldehyde,2-bromo-4-hydroxy-5-methoxy- , its CAS NO. is 60632-40-8, the synonyms are 6-Bromovanillin ; Vanillin, 6-bromo- .
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