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BENZOIC ACID, 4-AMINO-2-BROMO-, METHYL ESTER

BENZOIC ACID, 4-AMINO-2-BROMO-, METHYL ESTER structure

CAS No:
98545-64-3
Formula:
C8H8BrNO2
Chemical Name:
BENZOIC ACID, 4-AMINO-2-BROMO-, METHYL ESTER
Synonyms:
methyl 4-amino-2-bromobenzoate;Benzoic acid, 4-amino-2-bromo-, methyl ester;4-amino-2-bromo-benzoic acid methyl ester;methyl-2-bromo-4-aminobenzoate;SCHEMBL3172089;DTXSID80412824;ZINC1512285;BBL023766;CL9065;KM3478
Categories:
Organic Chemistry > Coordination Complexes

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BENZOIC ACID, 4-AMINO-2-BROMO-, METHYL ESTER Basic Attributes

Molecular Weight：

230.05862

Exact Mass：

228.973831

DSSTox ID：

DTXSID80412824

HScode：

2922499990

Characteristics

PSA：

52.3

XLogP3：

2.8

Density：

1.6±0.1 g/cm3

Melting Point：

94 °C

Boiling Point：

345.2°C at 760 mmHg

Flash Point：

162.6±22.3 °C

Refractive Index：

1.601

Computed Properties

Molecular Weight:230.06
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:228.97384
Monoisotopic Mass:228.97384
Topological Polar Surface Area:52.3
Heavy Atom Count:12
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 98545-64-3

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Guide of BENZOIC ACID, 4-AMINO-2-BROMO-, METHYL ESTER

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