4-Aminobenzaldehyde

HCID 11158

Notes Reactions

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Basic information

CAS: 28107-09-7
Standard SMILES: Nc1ccc(C=O)cc1
InChIKey: VATYWCRQDJIRAI-UHFFFAOYSA-N
Molecular formula: C7H7NO
Average molar mass: 121.14 g/mol
Monoisotopic mass: 121.05276384

Overview

P-aminobenzaldehyde is a member of benzaldehydes.

Names & identifiers

Preferred name: 4-Aminobenzaldehyde
IUPAC: 4-aminobenzaldehyde
English name: 4-Aminobenzaldehyde polymer
Molecular formula: C7H7NO
Molecular weight: 121.13658

Names & synonyms

4-Aminobenzaldehyde556-18-3Benzaldehyde, 4-amino-P-AMINOBENZALDEHYDEp-Formylaniline4-FormylanilineBenzaldehyde, p-amino-NSC-4516374Q1671TS1CCRIS-8885DTXSID3060299RefChem:518178

Show more names

4-Aminobenzaldehyde polymerP-AMINOBENZALDEHYDE, POLYMER4-aminobenzaldehyde homopolymerBenzaldehyde, 4-amino-,homopolymer

DTXCID7041910209-115-228107-09-74-amino-benzaldehydeMFCD00038137EINECS 209-115-2NSC 45163BRN 1362885

Database identifiers

CAS: 28107-09-7、556-18-3
PubChem CID: 11158
DTXSID: DTXSID3060299
ChEMBL: CHEMBL1885510
ChEBI: CHEBI:190128
UNII: 74Q1671TS1
EC Number: 209-115-2
Nikkaji: J38.172A

Properties

Computed structural properties

XLogP: 0.8
Topological polar surface area: 43.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 9
Formal charge: 0
Complexity: 95.1

Physicochemical properties

form: powder to crystal
color: Orange to Brown
Risk Statements: 20 · 20-37
Safety Statements: 23 · 23-38-45
HS Code: 2921.42 · 2921.42.9000

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.