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1,3-Di(methyl-13C)benzene

1,3-Di(methyl-13C)benzene structure

CAS No:
117713-57-2
Formula:
C8H10
Chemical Name:
1,3-Di(methyl-13C)benzene
Synonyms:
Benzene,1,3-di(methyl-13C)-;m-Xylene-α,α′-13C2;1,3-Di(methyl-13C)benzene

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1,3-Di(methyl-13C)benzene Basic Attributes

Molecular Weight：

108.15000

Exact Mass：

108.084959990

DSSTox ID：

DTXSID40583887

Characteristics

PSA：

0.00000

XLogP3：

2.30340

Density：

0.884g/mL

Melting Point：

-48ºC

Boiling Point：

138-139ºC

Flash Point：

77ºF

Refractive Index：

n20/D 1.497(lit.)

Safety Information

Transport codes：

UN 1307 3/PG 3

hazard class code：

R20/21/22; R36/37/38

safety instructions：

S16; S26; S36

Marks：

Computed Properties

Molecular Weight:108.15
XLogP3:3.2
Exact Mass:108.084959990
Monoisotopic Mass:108.084959990
Heavy Atom Count:8
Complexity:58.4
Isotope Atom Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Di(methyl-13C)benzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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