AG00BBPB

29897-82-3 | 1-Benzyl-pyrrolidine

AG00BBPB

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CAS Number	29897-82-3
Catalog Number	AG00BBPB(AGN-PC-0JLNYY)
Chemical Name	1-Benzyl-pyrrolidine
EC Number	249-936-3
IUPAC Name	1-benzylpyrrolidine
InChI	InChI=1S/C11H15N/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h1-3,6-7H,4-5,8-10H2
InChI Key	CWEGCQIIDCZZED-UHFFFAOYSA-N
MDL Number	MFCD00127807
Molecular Formula	C11H15N
Molecular Weight	161.2435
SMILES	N1(CC2=CC=CC=C2)CCCC1
Synonyms	1-benzylpyrrolidine, 1-Benzylpyrrolidine, 29897-82-3, N-Benzylpyrrolidine, 1-BENZYL-PYRROLIDINE, benzylpyrrolidine, Pyrrolidine, 1-(phenylmethyl)-, 1-(Phenylmethyl)pyrrolidine, CHEMBL2030631, CWEGCQIIDCZZED-UHFFFAOYSA-N, 1-(Benzyl)pyrrolidine, EINECS 249-936-3, N-benzyl-pyrrolidine, 1-Benzylpyrrolidine #, Pyrrolidine, 1-benzyl-, AC1L3UPD, AC1Q1H0W, SCHEMBL13952, pyrrolidin-1-ylmethyl benzene, Pyrrolidine,1-(phenylmethyl)-, CTK4G4015, KS-00000GRK, DTXSID30184009, ZINC2581987, BDBM50384283, CL2811, MFCD00127807, STK116065, AKOS005399424, DS-6821, MCULE-8241404624, AJ-43053, AK140155, DA-07223, SC-70526, AB0070192, ST2403329, 4CH-017081, CS-0031418, FT-0607388, ST50405825, X-2935, C11H15N, AR-1C1887, C11-H15-N, CID122501, ACN-036022, 30745-55-2,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.12g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	161.248g/mol
Monoisotopic Mass	161.12g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	3.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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