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3-ANILINO-4-ETHOXYCYCLOBUT-3-ENE-1,2-DIONE

3-ANILINO-4-ETHOXYCYCLOBUT-3-ENE-1,2-DIONE structure

CAS No:
42132-09-2
Formula:
C12H11NO3
Chemical Name:
3-ANILINO-4-ETHOXYCYCLOBUT-3-ENE-1,2-DIONE
Synonyms:
3-anilino-4-ethoxycyclobut-3-ene-1,2-dione;3-ethoxy-4-(phenylamino)cyclobut-3-ene-1,2-dione;3-Cyclobutene-1,2-dione, 3-ethoxy-4-(phenylamino)-;SCHEMBL6549773;DTXSID10381771;ZINC2555980;DB-128341;FT-0615077;3-Ethoxy-4-anilino-3-cyclobutene-1,2-dione;4-anilino-3-ethoxy-3-cyclobutene-1,2-dione
Categories:
Organic Chemistry > Coordination Complexes

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3-ANILINO-4-ETHOXYCYCLOBUT-3-ENE-1,2-DIONE Basic Attributes

Molecular Weight：

217.22

Exact Mass：

217.07400

DSSTox ID：

DTXSID10381771

HScode：

2922509090

Characteristics

PSA：

55.4

XLogP3：

1.57140

Density：

1.26g/cm3

Boiling Point：

359.6ºC at 760 mmHg

Flash Point：

171.3ºC

Refractive Index：

1.587

Computed Properties

Molecular Weight:217.22
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:217.07389321
Monoisotopic Mass:217.07389321
Topological Polar Surface Area:55.4
Heavy Atom Count:16
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-ANILINO-4-ETHOXYCYCLOBUT-3-ENE-1,2-DIONE

Basic Attributes
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