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4-(pyrrolidin-1-ylmethyl)benzaldehyde

4-(pyrrolidin-1-ylmethyl)benzaldehyde structure

CAS No:
650628-72-1
Formula:
C12H15NO
Chemical Name:
4-(pyrrolidin-1-ylmethyl)benzaldehyde
Synonyms:
4-pyrrolidin-1-ylmethyl-benzaldehyde;

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4-(pyrrolidin-1-ylmethyl)benzaldehyde Basic Attributes

Molecular Weight：

189.25400

Exact Mass：

189.115364102

DSSTox ID：

DTXSID80630506

HScode：

2933990090

Characteristics

PSA：

20.31000

XLogP3：

2.03280

Density：

1.114g/cm3

Boiling Point：

298.9ºC

Flash Point：

109.6ºC

Refractive Index：

1.598

Safety Information

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P310, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:189.25
XLogP3:1.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:189.115364102
Monoisotopic Mass:189.115364102
Topological Polar Surface Area:20.3
Heavy Atom Count:14
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(pyrrolidin-1-ylmethyl)benzaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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