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Structure

N-(4-Amino-2-methylphenyl)-2-methoxyacetamide

CAS
926271-83-2
Catalog Number
ACM926271832
Category
Other Products
Molecular Weight
194.230360 [g/mol]
Molecular Formula
C10H14N2O2

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Specification

Synonyms
N-(4-AMINO-2-METHYLPHENYL)-2-METHOXYACETAMIDE, 926271-83-2, Ambcb9197068, AGN-PC-015UTQ, CTK5H1531, MolPort-004-295-337, ZINC08703475, AKOS000102261, AG-H-79439, MCULE-3899198073, AK121011
IUPAC Name
N-(4-amino-2-methylphenyl)-2-methoxyacetamide
Canonical SMILES
CC1=C(C=CC(=C1)N)NC(=O)COC
InChI Key
YXWPCADWCCAKMF-UHFFFAOYSA-N
Boiling Point
288.813ºC at 760 mmHg
Flash Point
128.47ºC
Density
1.185g/cm³
Exact Mass
194.10600
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of the compound identified by PubChem CID 16775025?

The molecular formula is C10H14N2O2.

What is the computed molecular weight of the compound?

The molecular weight is 194.23 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is N-(4-amino-2-methylphenyl)-2-methoxyacetamide.

What is the InChIKey of the compound?

The InChIKey is YXWPCADWCCAKMF-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the exact mass of the compound?

The exact mass is 194.105527694 g/mol.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the XLogP3 value of the compound?

The XLogP3 value is 0.5.

What is the topological polar surface area of the compound?

The topological polar surface area is 64.4 Ų.

How many rotatable bond counts does the compound have?

The compound has 3 rotatable bond counts.

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