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1-(2-isocyanatoethyl)-4-methoxybenzene

1-(2-isocyanatoethyl)-4-methoxybenzene structure

CAS No:
52634-59-0
Formula:
C10H11NO2
Chemical Name:
1-(2-isocyanatoethyl)-4-methoxybenzene
Synonyms:
4-methoxyphenethyl isocyanate; F2160-0011; 1-(2-Isocyanatoethyl)-4-methoxybenzene (2-(4-Methoxyphenyl)ethyl isocyanate; 1-(2-isocyanato-ethyl)-4-methoxy-benzene;

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1-(2-isocyanatoethyl)-4-methoxybenzene Basic Attributes

Molecular Weight：

177.20000

Exact Mass：

177.078978594

DSSTox ID：

DTXSID80401773

HScode：

2929109000

Characteristics

PSA：

38.66000

XLogP3：

1.57350

Density：

1.105 g/mL at 25ºC(lit.)

Boiling Point：

279-280ºC(lit.)

Flash Point：

>230 °F

Refractive Index：

n20/D 1.5280(lit.)

Safety Information

hazard class code：

R20/21/22; R36/37/38; R42

safety instructions：

S23; S26; S36

Marks：

Computed Properties

Molecular Weight:177.20
XLogP3:2.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:177.078978594
Monoisotopic Mass:177.078978594
Topological Polar Surface Area:38.7
Heavy Atom Count:13
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-isocyanatoethyl)-4-methoxybenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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