CAS
99361-29-2 Purity
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99361-29-2 Purity
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4-(4-Nitrophenyl)-2-pyrimidinamine
CAS
99361-84-9
Catalog Number
ACM99361849
Category
Other Products
Molecular Weight
216.196120 [g/mol]
Molecular Formula
C10H8N4O2
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Specification
Synonyms
4-(4-nitrophenyl)pyrimidin-2-amine, 99361-84-9, 4-(4-Nitrophenyl)-2-pyrimidinamine, SBB019168, 4-(4-nitrophenyl)pyrimidine-2-ylamine, ZINC00172557, nitrophenylpyrimidinamine, SureCN4526945, AC1ME804, AC1Q52K4, CTK7E1198, MolPort-001-770-701, CCG-49658, STK790240, AKOS002659329, AG-A-67819, AG-B-89404, MCULE-4593981015, RP12510, AK-69479
IUPAC Name
4-(4-nitrophenyl)pyrimidin-2-amine
Canonical SMILES
C1=CC(=CC=C1C2=NC(=NC=C2)N)[N+](=O)[O-]
InChI Key
CEFMGOCCUMHYKX-UHFFFAOYSA-N
Exact Mass
216.06500
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of the compound with PubChem CID 2824420?
The molecular formula is C10H8N4O2.
When was the compound with PubChem CID 2824420 created?
It was created on July 19, 2005.
What is the molecular weight of the compound?
The molecular weight is 216.20 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 4-(4-nitrophenyl)pyrimidin-2-amine.
What is the InChIKey of the compound?
The InChIKey is CEFMGOCCUMHYKX-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has a hydrogen bond donor count of 1.
What is the topological polar surface area of the compound?
The topological polar surface area is 97.6 Ų.
How many heavy atoms are present in the compound?
There are 16 heavy atoms in the compound.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 1.3.
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