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2,2′-Dibromobiphenyl

2,2′-Dibromobiphenyl structure

CAS No:
13029-09-9
Formula:
C12H8Br2
Chemical Name:
2,2′-Dibromobiphenyl
Synonyms:
1,1′-Biphenyl,2,2′-dibromo-;Biphenyl,2,2′-dibromo-;2,2′-Dibromo-1,1′-biphenyl;2,2′-Dibromobiphenyl;o,o′-Dibromobiphenyl;2,2′-Dibromodiphenyl;NSC 91566;PBB 4;1-Bromo-2-(2-bromophenyl)benzene
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

white crystalline powder

2,2′-Dibromobiphenyl Basic Attributes

Molecular Weight：

312

Exact Mass：

312.00

EC Number：

1592732-453-0

UNII：

GSL06P6P2L

NSC Number：

91566

DSSTox ID：

DTXSID5074761

HScode：

29039990

Characteristics

PSA：

XLogP3：

5.11

Appearance：

White Crystalline Powder

Density：

1.667

Melting Point：

81 °C @ Solvent: Ethanol

Boiling Point：

332.9±17.0 °C(Predicted)

Flash Point：

180.0±20.2 °C

Refractive Index：

1.626

Water Solubility：

Insoluble in water.

Safety Information

Packing level：

Hazard category：

Transport codes：

UN3152

wgk germany：

hazard class code：

36/37/38-50/53-22

safety instructions：

37/39-26-61-60-36/37

Marks：

Xi,N,Xn

Precautionary statement(s)：

P273-P280-P301 + P312 + P330-P337 + P313-P391-P501

Hazard Statements：

H302-H315-H319-H335-H410

GHS Classification：

|Warning|H302 (86.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:312.00
XLogP3:5.1
Rotatable Bond Count:1
Exact Mass:311.89723
Monoisotopic Mass:309.89928
Heavy Atom Count:14
Complexity:161
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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