CAS
926198-75-6 Purity
96%
926198-75-6 Purity
96%
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3-Amino-4-chloro-N-propylbenzamide
CAS
926201-28-7
Catalog Number
ACM926201287
Category
Other Products
Molecular Weight
212.676020 [g/mol]
Molecular Formula
C10H13ClN2O
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Specification
Synonyms
3-AMINO-4-CHLORO-N-PROPYLBENZAMIDE, 926201-28-7, Ambcb4027384, AGN-PC-015USK, CTK5H1483, MolPort-004-295-298, ZINC19092329, 3-Amino-4-chloro-N-propyl-benzamide, AKOS000113226, AG-H-79375, MCULE-8973493250
IUPAC Name
3-amino-4-chloro-N-propylbenzamide
Canonical SMILES
CCCNC(=O)C1=CC(=C(C=C1)Cl)N
InChI Key
YRIUVHASSWIDON-UHFFFAOYSA-N
Boiling Point
351.764ºC at 760 mmHg
Flash Point
166.541ºC
Density
1.201g/cm³
Exact Mass
212.07200
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular weight of the keyword 3-Amino-4-chloro-N-propylbenzamide?
The molecular weight of 3-Amino-4-chloro-N-propylbenzamide is 212.67 g/mol.
What is the IUPAC name of the keyword?
The IUPAC name of the keyword is 3-amino-4-chloro-N-propylbenzamide.
What is the InChIKey of the keyword?
The InChIKey of the keyword is YRIUVHASSWIDON-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the keyword have?
The keyword has 2 hydrogen bond donor counts.
What is the XLogP3 value of the keyword?
The XLogP3 value of the keyword is 1.8.
What is the topological polar surface area of the keyword?
The topological polar surface area of the keyword is 55.1 Å2.
Does the keyword have any defined atom stereocenter count?
No, the keyword does not have any defined atom stereocenter count.
What is the canonical SMILES representation of the keyword?
The canonical SMILES representation of the keyword is CCCNC(=O)C1=CC(=C(C=C1)Cl)N.
What is the formal charge of the keyword?
The formal charge of the keyword is 0.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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