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Cyclobutanemethanamine

Cyclobutanemethanamine structure

CAS No:
4415-83-2
Formula:
C5H11N
Chemical Name:
Cyclobutanemethanamine
Synonyms:
Cyclobutanemethanamine;Cyclobutanemethylamine;Cyclobutylmethylamine;(Aminomethyl)cyclobutane;Cyclobutylmethaneamine;Cyclobutylmethanamine;1-Cyclobutylmethanamine
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Cyclobutanemethanamine Basic Attributes

Molecular Weight：

85.15

Exact Mass：

85.15

DSSTox ID：

DTXSID40328376

HScode：

2921300090

Characteristics

PSA：

XLogP3：

0.6

Density：

0.9±0.1 g/cm3

Boiling Point：

90.6°C at 760 mmHg

Flash Point：

2.1±13.3 °C

Refractive Index：

1.469

Safety Information

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, P501

Hazard Statements：

H225

GHS Classification：

|Danger|H225 (50%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P370+P378, P403+P235, P405, and P501|Aggregated GHS information provided by 4 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Cyclobutanemethanamine Use and Manufacturing

General procedure: To a N2-purged solution of 19 (1 equiv.) in DCM (4 mL per equiv. of 19) was added K2CO3 (5 equiv.) and the corresponding amine (2.5 equiv.) (3 equiv. of Et3N was added for HCl salts). AlMe3 (2.5 equiv.) was slowly added and the reaction mixture was stirred at rt overnight. The reaction mixture was carefully poured in 1M aq. HCl (100 mL) and extracted with EtOAc(100 mL). The organic phase was washed with brine (100 mL), dried over MgSO4, filtered and concentrated to obtain the crude product as a brown solid. The crude product was purified using flash column chromatography.

Computed Properties

Molecular Weight:85.15
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:85.089149355
Monoisotopic Mass:85.089149355
Topological Polar Surface Area:26
Heavy Atom Count:6
Complexity:39.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Cyclobutylmethylamine

CAS No.: 4415-83-2

Content: 99.00%

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