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4-Isopropoxybenzaldehyde

4-Isopropoxybenzaldehyde structure

CAS No:
18962-05-5
Formula:
C10H12O2
Chemical Name:
4-Isopropoxybenzaldehyde
Synonyms:
Benzaldehyde,4-(1-methylethoxy)-;Benzaldehyde,p-isopropoxy-;4-(1-Methylethoxy)benzaldehyde;4-Isopropoxybenzaldehyde;p-Isopropoxybenzaldehyde;4-(Isopropyloxy)benzaldehyde;p-(Isopropyloxy)benzaldehyde;NSC 69072;4-[(1-Methylethyl)oxy]benzaldehyde;4-(Propan-2-yloxy)benzaldehyde
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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4-Isopropoxybenzaldehyde Basic Attributes

Molecular Weight：

164.20 g/mol

Exact Mass：

164.20

NSC Number：

69072

DSSTox ID：

DTXSID50290510

Characteristics

PSA：

26.3 Å²

Melting Point：

167 °C

Boiling Point：

135-136 °C

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:164.20
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:164.083729621
Monoisotopic Mass:164.083729621
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:135
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes