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1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester

1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester structure

CAS No:
1100748-67-1
Formula:
C21H32N2O2
Chemical Name:
1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester
Synonyms:
tert-butyl 1-benzyl-1,9-diazaspiro[5.5]undecane-9-carboxylate;tert-Butyl 1-benzyl-1,9-diazaspiro-[5.5]undecane-9-carboxylate;DTXSID70649142;KS-000022ZW;ZINC59111387;AKOS015991263;BG-0705;1,9-Diazaspiro[5.5]undecane-9-carboxylic acid,1-(phenylmethyl)-,1,1-dimethylethyl ester

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1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester Basic Attributes

Molecular Weight：

344.49098

Exact Mass：

344.24600

DSSTox ID：

DTXSID70649142

Characteristics

PSA：

32.78000

XLogP3：

4.31800

Density：

1.09±0.1 g/cm3(Predicted)

Boiling Point：

443.7±38.0 °C(Predicted)

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:344.5
XLogP3:3.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:344.246378268
Monoisotopic Mass:344.246378268
Topological Polar Surface Area:32.8
Heavy Atom Count:25
Complexity:443
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester

SDS

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