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ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate

ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate structure

CAS No:
49765-05-1
Formula:
C7H7Cl3N2O2
Chemical Name:
ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate
Synonyms:
(Z)-ethyl 3-amino-4,4,4-trichloro-2-cyanobut-2-enoate;49765-05-1;ethyl (2Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate;ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate;MFCD00181228;22071-00-7;SCHEMBL11890432;ZBA76505;STK052332;ZINC19789278;AKOS002345290;NE41127;AS-69374;CS-0038378;EN300-18652;2-Cyano-3-amino-4,4,4-trichlorocrotonic acid ethyl ester;ethyl (2Z)-3-amino-4,4,4-trichloro-2-cyano-2-butenoate

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ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate Basic Attributes

Molecular Weight：

257.5 g/mol

Exact Mass：

255.957311 g/mol

Characteristics

PSA：

76.1 Å²

XLogP3：

2.35638

Safety Information

GHS Classification：

|Danger|H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:257.5
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:255.957311
Monoisotopic Mass:255.957311
Topological Polar Surface Area:76.1
Heavy Atom Count:14
Complexity:311
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl (Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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