CAS
930-91-6 Purity
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930-91-6 Purity
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N-(2-Diethylaminoethyl)-2,4-dinitroaniline
CAS
93098-75-0
Catalog Number
ACM93098750
Category
Other Products
Molecular Weight
282.295720 [g/mol]
Molecular Formula
C12H18N4O4
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Specification
Synonyms
56223-91-7, BRN 2818037, ANILINE, N-(2-(DIETHYLAMINO)ETHYL)-2,4-DINITRO-, N-(Diethylaminoethyl)-2,4-dinitroaniline, AI3-62292, ST4012670, {2-[(2,4-dinitrophenyl)amino]ethyl}diethylamine, N-(2-DIETHYLAMINOETHYL)-2,4-DINITROANILINE, 1,2-Ethanediamine, N-(2,4-dinitrophenyl)-N,N-diethyl-, NSC85867, AC1Q2ZCR, Oprea1_114976, CBDivE_005980, AC1L26I1, ARONIS013310, CTK5H2093, MolPort-001-822-905, NSC-85867, STK010990, AKOS000504013
IUPAC Name
N-(2,4-dinitrophenyl)-N,N-diethylethane-1,2-diamine
Canonical SMILES
CCN(CC)CCNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
InChI Key
HGZRREOJHASMOE-UHFFFAOYSA-N
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of N-(2-Diethylaminoethyl)-2,4-dinitroaniline?
The molecular formula is C12H18N4O4.
What are some synonyms for N-(2-Diethylaminoethyl)-2,4-dinitroaniline?
Some synonyms include ANILINE, N-(2-(DIETHYLAMINO)ETHYL)-2,4-DINITRO, and N-(2,4-dinitrophenyl)-N',N'-diethylethane-1,2-diamine.
When was the compound created?
The compound was created on March 26, 2005.
What is the molecular weight of N-(2-Diethylaminoethyl)-2,4-dinitroaniline?
The molecular weight is 282.30 g/mol.
What is the InChIKey for N-(2-Diethylaminoethyl)-2,4-dinitroaniline?
The InChIKey is HGZRREOJHASMOE-UHFFFAOYSA-N.
How many hydrogen bond donor counts does N-(2-Diethylaminoethyl)-2,4-dinitroaniline have?
It has 1 hydrogen bond donor count.
What is the XLogP3 value for N-(2-Diethylaminoethyl)-2,4-dinitroaniline?
The XLogP3 value is 3.
What is the topological polar surface area of N-(2-Diethylaminoethyl)-2,4-dinitroaniline?
The topological polar surface area is 107?2.
How many rotatable bond counts does N-(2-Diethylaminoethyl)-2,4-dinitroaniline have?
It has 6 rotatable bond counts.
Is the compound Canonicalized?
Yes, the compound is Canonicalized according to PubChem.
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