Methane-13C-d, trichloro-
CHCl₃·121.370 g/mol·CID 101644856
IUPAC: trichloro(deuterio)(113C)methane
Also known as: 32488-46-3, RefChem:352158, Trichloro(~13~C,~2~H)methane, DTXSID901312641, Chloroform-13C,d, 99 atom % 13C, 99 atom % D
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
121.370g/mol
Exact Mass
119.924015Da
Monoisotopic Mass
119.924015Da
XLogP
2.3
Polar Surface Area
0.0Ų
Complexity
8
Formal Charge
0
H-Bond Donors
0
H-Bond Acceptors
0
Rotatable Bonds
0
Heavy Atoms
4
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 121.4 g/mol
MW ≤ 500
✓ 2.3
LogP ≤ 5
✓ 0
H-bond donors ≤ 5
✓ 0
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
GHS Hazard Classification
Warning
Hazards
H302Harmful if swallowedH315Causes skin irritationH319Causes serious eye irritationH351Suspected of causing cancerH373May causes damage to organs through prolonged or repeated exposure
Source: PubChem GHS Classification. Always consult the SDS for handling.
Isomers8 compounds with formula CHCl₃
chloroform
CID 6212 · 119.4 g/mol
trichloro(deuterio)methane
CID 71583 · 120.4 g/mol
trichloro(113C)methane
CID 10176135 · 120.4 g/mol
trichloro(114C)methane
CID 12224983 · 121.4 g/mol
trichloro(tritio)methane
CID 53872522 · 121.4 g/mol
CID 59268277
CID 59268277 · 119.4 g/mol
chloro(chloromethylidene)-lambda3-chlorane
CID 77520523 · 119.4 g/mol
1lambda3-chlora-2,4-dichloroniabicyclo[1.1.0]butane
CID 139120468 · 119.4 g/mol