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2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOICACID

2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOICACID structure

CAS No:
253677-29-1
Formula:
C12H14ClNO4
Chemical Name:
2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOICACID
Synonyms:
ANTHRANILIC ACID, N-BOC-5-CHLORO;BOC-2-AMINO-5-CHLOROBENZOIC ACID;2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOIC ACID 90%;N-BOC-5-CHLOROANTHRANILIC ACID;2-Tert-Butoxycarbonylamino-5-chlorolbenzoic acid;2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOIC ACID;5-Chloro-2-((tert-butoxycarbonyl)amino)benzoic acid;5-chloro-2-[[(1,1-dimethylethoxy)carbonyl]amino]-benzoic acid

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2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOICACID Basic Attributes

Molecular Weight：

271.7

Exact Mass：

271.0611356 g/mol

DSSTox ID：

DTXSID10363956

HScode：

2924299090

Characteristics

PSA：

75.63000

XLogP3：

3.45820

Density：

1.338±0.06 g/cm3

Boiling Point：

350.4±32.0 °C(Predicted)

Flash Point：

165.7ºC

Refractive Index：

1.584

Vapor Pressure：

1.65E-05mmHg at 25°C

PKA：

3.33±0.36

Safety Information

Hazard category：

IRRITANT

hazard class code：

safety instructions：

24/25-36/37

Marks：

Computed Properties

Molecular Weight:271.69
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:271.0611356
Monoisotopic Mass:271.0611356
Topological Polar Surface Area:75.6
Heavy Atom Count:18
Complexity:327
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-TERT-BUTOXYCARBONYLAMINO-5-CHLORO-BENZOICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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