4-(dimethylamino)butanoic acid chloride

4-(dimethylamino)butanoic acid chloride

CAS: 69954-66-1

Formula: C6H13ClNO2

SMILES: [Cl-].CN(C)CCCC(O)=O

IUPAC: 4-(dimethylamino)butanoic acid chloride

InChI: InChI=1S/C6H13NO2.ClH/c1-7(2)5-3-4-6(8)9;/h3-5H2,1-2H3,(H,8,9);1H/p-1

Composition: C (43.25%), H (7.86%), Cl (21.28%), N (8.41%), O (19.20%)

Molar Mass: 166.63

Atom Count: 23

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	166.0640299
Formal Charge	-1
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RDTALXUBMCLWBB-UHFFFAOYSA-M
Lipinski's Rule of Five	1
Molar Refractivity	35.53
Topological Polar Surface Area	40.54
Polarizability	13.84
Ring Count	0
Rotatable Bond Count	4

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