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2-Bromodiphenylamine

2-Bromodiphenylamine structure

CAS No:
61613-22-7
Formula:
C12H10BrN
Chemical Name:
2-Bromodiphenylamine
Synonyms:
2-Bromodiphenylamine;2-BDPA;2-bromo-n-phenylaniline;2-bromo-N-phenylbenzenamine;Benzenamine, 2-bromo-N-phenyl-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-Bromodiphenylamine Basic Attributes

Molecular Weight：

248.1185

Exact Mass：

247.00000

DSSTox ID：

DTXSID70423762

Characteristics

PSA：

XLogP3：

4.2

Density：

1.445±0.06 g/cm3(Predicted)

Melting Point：

49 °C

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:248.12
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:246.99966
Monoisotopic Mass:246.99966
Topological Polar Surface Area:12
Heavy Atom Count:14
Complexity:166
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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