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4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER

4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER structure

CAS No:
631911-01-8
Formula:
C13H20BNO2
Chemical Name:
4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER
Synonyms:
3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER;4-Amino-2-methylphenylboronic acid pinacol ester;SCHEMBL58186;DTXSID80590353;AKOS015960141;ZINC169743559;A-3745;4-Amino-2-methylphenylboronic acid,pinacol ester;4-Amino-2-methylphenylboronic acid pinacol ester, AldrichCPR

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4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER Basic Attributes

Molecular Weight：

233.11

Exact Mass：

233.15900

DSSTox ID：

DTXSID80590353

HScode：

2934999090

Characteristics

PSA：

44.5

XLogP3：

2.45760

Density：

1.039g/cm3

Boiling Point：

356.434ºC at 760 mmHg

Flash Point：

169.366ºC

Refractive Index：

1.515

Safety Information

hazard class code：

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:233.12
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:233.1587090
Monoisotopic Mass:233.1587090
Topological Polar Surface Area:44.5
Heavy Atom Count:17
Complexity:277
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER

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CAS No.: 631911-01-8

Content: 98%

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Guide of 4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER

Basic Attributes
Characteristics
Safety Information
Computed Properties
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4-AMINO-2-METHYLPHENYLBORONIC ACID, PINACOL ESTER

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