CAS
915390-10-2 Purity
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915390-10-2 Purity
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2-Quinazolinamine,4-chloro-N,N-dimethyl-
CAS
91539-82-1
Catalog Number
ACM91539821
Category
Other Products
Molecular Weight
221.68608
Molecular Formula
C10H10ClN3
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- Synthetic Use
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Specification
Synonyms
4-CHLORO-N,N-DIMETHYL-2-QUINAZOLINEMETHANAMINE;(4-chloroquinazolin-2-yl)-N,N-dimethylmethanamine
IUPAC Name
1-(4-chloroquinazolin-2-yl)-N,N-dimethylmethanamine
SMILES
CN(C)CC1=NC2=CC=CC=C2C(=N1)Cl
InChI Key
FOYZORGYMUFUBD-UHFFFAOYSA-N
Boiling Point
259.1ºC at 760 mmHg
Flash Point
110.5ºC
Density
1.241g/cm³
Exact Mass
221.07200
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2-Quinazolinamine, 4-chloro-N,N-dimethyl?
The molecular formula is C11H12ClN3.
What are some synonyms for 2-Quinazolinamine, 4-chloro-N,N-dimethyl?
Some synonyms include 1-(4-chloroquinazolin-2-yl)-N,N-dimethylmethanamine, 91539-82-1, and Nonylformate.
What is the molecular weight of 2-Quinazolinamine, 4-chloro-N,N-dimethyl?
The molecular weight is 221.68 g/mol.
When was 2-Quinazolinamine, 4-chloro-N,N-dimethyl created and modified in PubChem?
It was created on September 10, 2005, and last modified on December 30, 2023.
What is the IUPAC Name of 2-Quinazolinamine, 4-chloro-N,N-dimethyl?
The IUPAC Name is 1-(4-chloroquinazolin-2-yl)-N,N-dimethylmethanamine.
What is the InChI key of 2-Quinazolinamine, 4-chloro-N,N-dimethyl?
The InChI key is FOYZORGYMUFUBD-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts does 2-Quinazolinamine, 4-chloro-N,N-dimethyl have?
It has 3 hydrogen bond acceptor counts.
What is the topological polar surface area of 2-Quinazolinamine, 4-chloro-N,N-dimethyl?
The topological polar surface area is 29 Å^2.
How many rotatable bond counts does 2-Quinazolinamine, 4-chloro-N,N-dimethyl have?
It has 2 rotatable bond counts.
Is 2-Quinazolinamine, 4-chloro-N,N-dimethyl a canonicalized compound in PubChem?
Yes, it is a canonicalized compound in PubChem.
Upstream Synthesis Route 1
- 91539-79-6
- 91539-82-1
Reference: [1]Kokel, Bruno; Menichi, Gabriel; Hubert-Habart, Michel
[Tetrahedron Letters, 1984, vol. 25, # 15, p. 1557 - 1560]
Downstream Synthesis Route 1
- 91539-82-1
- 40172-75-6
Reference: [1]Kokel, Bruno
[Heterocycles, 1984, vol. 21, # 2, p. 709]
Downstream Synthesis Route 2
- 91539-82-1
- 20186-98-5
Reference: [1]Kokel, Bruno
[Heterocycles, 1984, vol. 21, # 2, p. 709]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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