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trans-Benzyl (4-methylpyrrolidin-3-YL)carbamate hcl

HCID 178952989
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Basic information

CAS
1951441-29-4
Standard SMILES
C[C@@H]1CNC[C@H]1NC(=O)OCc1ccccc1.Cl
InChIKey
BSMSBZLVNPGRCO-MHDYBILJSA-N
Molecular formula
C13H19ClN2O2
Average molar mass
270.75 g/mol

Names & identifiers

Preferred name
trans-Benzyl (4-methylpyrrolidin-3-YL)carbamate hcl
IUPAC
benzyl N-[(3S,4R)-4-methylpyrrolidin-3-yl]carbamate;hydrochloride
English name
trans-Benzyl (4-methylpyrrolidin-3-yl)carbamate HCl
Molecular formula
C13H18N2O2.ClH
Molecular weight
270.76

Names & synonyms

TRANS-BENZYL (4-METHYLPYRROLIDIN-3-YL)CARBAMATE HCL1951441-29-4MFCD279973992008714-49-4Benzyl ((3S,4R)-4-methylpyrrolidin-3-yl)carbamate hydrochloridebenzyl N-[(3S,4R)-4-methylpyrrolidin-3-yl]carbamate;hydrochloridetrans-3-(Cbz-amino)-4-methylpyrrolidine HydrochlorideAKOS037643890AS-39844SY259311F469643Benzyl((3S,4R)-4-methylpyrrolidin-3-yl)carbamatehydrochloride
Show more names
Trans-Benzyl (4-Methylpyrrolidin-3-Yl)Carbamate Hydrochloride
BENZYL N-[(3S,4R)-4-METHYLPYRROLIDIN-3-YL]CARBAMATE HYDROCHLORIDE

Database identifiers

CAS
1951441-29-4

Properties

Computed structural properties

Topological polar surface area
50.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
252

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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