CAS 865138-64-3 3-Bromo-4-propoxybenzaldehyde (HCID 4770041)

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Basic information

CAS: 865138-64-3
Standard SMILES: CCCOc1ccc(C=O)cc1Br
InChIKey: HDCNBZVVXWZSQO-UHFFFAOYSA-N
Molecular formula: C10H11BrO2
Average molar mass: 243.1 g/mol
Monoisotopic mass: 241.99424169

Names & identifiers

Preferred name: 3-Bromo-4-propoxybenzaldehyde
IUPAC: 3-bromo-4-propoxybenzaldehyde
English name: CHEMBRDG-BB 7613377
Molecular formula: C10H11BrO2
Molecular weight: 243.1

Names & synonyms

3-bromo-4-propoxybenzaldehyde865138-64-3MFCD074324973-bromo-4-propoxy-benzaldehydeSCHEMBL177168DTXSID40406380HDCNBZVVXWZSQO-UHFFFAOYSA-NQJB13864BBL023695STL289234AKOS000295119VS-07486

Show more names

CHEMBRDG-BB 7613377OTAVA-BB 7020683085Benzaldehyde, 3-bromo-4-propoxy-3-bromo-4-propoxybenzaldehyde(SALTDATA: FREE)

CS-0192234E90067F315501

Database identifiers

CAS: 865138-64-3
PubChem CID: 4770041
DTXSID: DTXSID40406380
EC Number: 171-908-3

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 13
Formal charge: 0
Complexity: 161

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 280 · P280-P305+P351+P338
Hazard Codes: Xn
Risk Statements: 22 · 22

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.