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ethyl 2-[(3-bromophenyl)methyl]-3-(methylamino)propanoate

ethyl 2-[(3-bromophenyl)methyl]-3-(methylamino)propanoate structure

CAS No:
886366-12-7
Formula:
C13H18BrNO2
Chemical Name:
ethyl 2-[(3-bromophenyl)methyl]-3-(methylamino)propanoate
Synonyms:
2-[(3-bromophenyl)methyl]-3-(methylamino)propanoic acid ethyl ester; Ethyl 3-(3-bromo-phenyl)-2-methylaminomethyl-propionate; Benzenepropanoic acid,3-bromo-a-[(methylamino)methyl]-,ethylester; Ethyl 3-(3-bromo-phenyl)-2-methylaminomethyl; 3-(3-bromo-phenyl)-2-methylaminomethyl-propionic acid ethyl ester;

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ethyl 2-[(3-bromophenyl)methyl]-3-(methylamino)propanoate Basic Attributes

Molecular Weight：

300.19200

Exact Mass：

299.05209

DSSTox ID：

DTXSID00661433

HScode：

2922499990

Characteristics

PSA：

38.33000

XLogP3：

2.78120

Density：

1.284g/cm3

Boiling Point：

369.7ºC at 760 mmHg

Flash Point：

177.4ºC

Refractive Index：

1.528

Computed Properties

Molecular Weight:300.19
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:299.05209
Monoisotopic Mass:299.05209
Topological Polar Surface Area:38.3
Heavy Atom Count:17
Complexity:236
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[(3-bromophenyl)methyl]-3-(methylamino)propanoate

Basic Attributes
Characteristics
Computed Properties
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