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N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMicAcid1,1-DiMethylethylEster

N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMicAcid1,1-DiMethylethylEster structure

CAS No:
293305-69-8
Formula:
C14H20INO2
Chemical Name:
N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMicAcid1,1-DiMethylethylEster
Synonyms:
N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMic Acid 1,1-DiMethylethyl Ester;(R)-2-(N-t-butoxycarbonylamino)-3-phenyl-1-iodopropane;tert-butyl N-[(2R)-1-iodo-3-phenylpropan-2-yl]carbamate;Carbamic acid, N-[(1R)-1-(iodomethyl)-2-phenylethyl]-, 1,1-dimethylethyl ester;(R)-N-Boc-α-(iodomethyl)benzeneethanamine

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N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMicAcid1,1-DiMethylethylEster Basic Attributes

Molecular Weight：

361.22

Exact Mass：

361.05388

DSSTox ID：

DTXSID30565798

Characteristics

Density：

1.428±0.06 g/cm3

Melting Point：

121-122 °C

Boiling Point：

405.0±45.0 °C(Predicted)

PKA：

11.81±0.46

N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMicAcid1,1-DiMethylethylEster Use and Manufacturing

Intermediate in the preparation of (S)-Amphetamine.

Computed Properties

Molecular Weight:361.22
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:361.05388
Monoisotopic Mass:361.05388
Topological Polar Surface Area:38.3
Heavy Atom Count:18
Complexity:257
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[(1R)-1-(IodoMethyl)-2-phenylethyl]carbaMicAcid1,1-DiMethylethylEster

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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