methyl 3-carbamoylpropanoate

methyl 3-carbamoylpropanoate

CAS: 53171-39-4

Formula: C5H9NO3

SMILES: COC(=O)CCC(N)=O

IUPAC: methyl 3-carbamoylpropanoate

InChI: InChI=1S/C5H9NO3/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3,(H2,6,7)

Composition: C (45.80%), H (6.92%), N (10.68%), O (36.60%)

Molar Mass: 131.131

Atom Count: 18

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	131.058243154
Formal Charge	0
FSP3	0.6
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HURZMSZDVGMYKJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	30.13
Topological Polar Surface Area	69.39
Polarizability	12.02
Ring Count	0
Rotatable Bond Count	4

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