AG00IB1B

625100-00-7 | 1,6-Naphthyridine, 3-bromo-5,6,7,8-tetrahydro-

AG00IB1B

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CAS Number	625100-00-7
Catalog Number	AG00IB1B(AGN-PC-01LR5E)
Chemical Name	1,6-Naphthyridine, 3-bromo-5,6,7,8-tetrahydro-
IUPAC Name	3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine
InChI	InChI=1S/C8H9BrN2/c9-7-3-6-4-10-2-1-8(6)11-5-7/h3,5,10H,1-2,4H2
InChI Key	IRZFIOXYROEMPD-UHFFFAOYSA-N
MDL Number	MFCD08059299
Molecular Formula	C8H9BrN2
Molecular Weight	213.0745
SMILES	BrC1=CC2=C(N=C1)CCNC2
Synonyms	3-Bromo-5,6,7,8-tetrahydro-1,6-naphthyridine, 625100-00-7, 1,6-NAPHTHYRIDINE, 3-BROMO-5,6,7,8-TETRAHYDRO-, 3-Bromo-5,6,7,8-tetrahydro-[1,6]naphthyridine, PubChem14710, SCHEMBL722943, CTK8C3104, DTXSID30590489, IRZFIOXYROEMPD-UHFFFAOYSA-N, BCP21952, ABBYPHARMA AP-13-10156, ANW-69673, AS0091, MFCD08059299, SC2711, ZINC12955602, AKOS015920357, PB26297, RP09343, RTR-021495, WT82573, AJ-63198, AN-16451, AS-54628, BC003918, BR-27393, SC-25010, AB0025897, 4CH-013087, BB 0260332, CS-0053996, FT-0646403, W7461, S-7376, J-511986, 3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine, AldrichCPR, 3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine?hydrochloride, C8H9BrN2, 3-Bromo-5,6,7,8-Tetrahydro-1,6-Naphthyridine Hydrochloride,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.995g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	213.078g/mol
Monoisotopic Mass	211.995g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	24.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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