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| CAS Number | 484-20-8 |
| Catalog Number | AG006WTT(AGN-PC-0JK67L) |
| Chemical Name | 5-Methoxypsoralen |
| EC Number | 207-604-5 |
| IUPAC Name | 4-methoxyfuro[3,2-g]chromen-7-one |
| InChI | InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3 |
| InChI Key | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
| MDL Number | MFCD00010272 |
| Molecular Formula | C12H8O4 |
| Molecular Weight | 216.1895 |
| SMILES | O=C1C=CC2=C(O1)C=C(OC=C3)C3=C2OC |
| UN Number | 1759 |
| UNII | 4FVK84C92X |
| Synonyms | 5 Methoxy Psoralen,
5 Methoxypsoralen,
5-Methoxy Psoralen,
5-methoxypsoralen,
bergapten,
Pentaderm,
Bergapten,
5-Methoxypsoralen,
484-20-8,
bergaptene,
Heraclin,
Majudin,
4-Methoxy-7H-furo[3,2-g]chromen-7-one,
BERGAPTAN,
Psoraderm,
5-Mop,
5-Methoxy psoralen,
O-Methylbergaptol,
5-Methoxy-6,7-furanocoumarin,
5-Methoxyfuranocoumarin,
Pentaderm,
7H-Furo[3,2-g][1]benzopyran-7-one, 4-methoxy-,
4-Methoxy-7H-furo(3,2-g)(1)benzopyran-7-one,
4-Methoxyfuro[3,2-g]benzopyran-7-one,
5-methoxypsoralene,
4-methoxyfuro[3,2-g]chromen-7-one,
UNII-4FVK84C92X,
NSC 95437,
Bergaptene (DCF),
CCRIS 4348,
HSDB 3466,
5-Methoxypsoralen with ultraviolet A therapy,
NSC95437,
6-Hydroxy-4-methoxy-5-benzofuranacrylic acid, gamma-lactone,
EINECS 207-604-5,
4-methoxy-7H-furo[3,2-g][1]benzopyran-7-one,
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-methoxy-,
BRN 0019560,
CHEMBL24171,
4FVK84C92X,
BGEBZHIAGXMEMV-UHFFFAOYSA-N,
MFCD00010272,
4-Methoxy-furo[3,2-g]chromen-7-one,
5-methoxyfurano[3,2-g]chromen-2-one,
4-Methoxyfuro[3,2-g]benzopyrane-7-one,
AK134854,
5-methoxy-2H-furo[3,2-g]chromen-2-one,
5-Methoxypsoralen, 98%,
DSSTox_CID_5560,
DSSTox_RID_77830,
DSSTox_GSID_25560,
Q-100536,
5 methoxypsoralen,
CAS-484-20-8,
SMR000112435,
SR-05000002173,
Geralen,
Bergapten(e),
Pentaderm (TN),
5-methoxy-psoralen,
Spectrum_000794,
AC1L1DHU,
Spectrum2_000534,
Spectrum3_000663,
Spectrum4_001478,
Spectrum5_000155,
5-Methoxypsoralen, 99%,
bmse000758,
AC1Q47BC,
5-Methoxypsoralen (obsol.),
7H-Furo[3, 4-methoxy-,
Oprea1_562364,
SCHEMBL50066,
BSPBio_002325,
KBioGR_002055,
KBioSS_001274,
SPECTRUM300546,
5-19-06-00004 (Beilstein Handbook Reference),
MLS002207272,
MLS002454380,
Bergapten, analytical standard,
DivK1c_000529,
5-Methoxypsoralen (Bergapten),
SPBio_000547,
MEGxp0_000990,
DTXSID1025560,
ACon0_000984,
ACon1_001979,
CHEBI:18293,
CTK3J2399,
HMS501K11,
KBio1_000529,
KBio2_001274,
KBio2_003842,
KBio2_006410,
KBio3_001545,
KS-00000GSD,
ZINC57731,
NINDS_000529,
HMS1923G13,
HMS2268M24,
HMS3652F19,
Pharmakon1600-00300546,
HY-N0370,
TNP00299,
Tox21_202357,
Tox21_303255,
ANW-42611,
BDBM50067880,
CCG-39946,
NSC-95437,
NSC755877,
s4239,
STK333038,
AKOS000276715,
AN-9448,
CB-1199,
CS-2234,
DB12216,
DS-2970,
LS-1292,
MCULE-7768334865,
NSC-755877,
RTR-017690,
SDCCGMLS-0066492.P001,
IDI1_000529,
NCGC00017357-01,
NCGC00017357-02,
NCGC00017357-03,
NCGC00017357-04,
NCGC00017357-05,
NCGC00017357-06,
NCGC00017357-07,
NCGC00017357-08,
NCGC00091582-01,
NCGC00091582-02,
NCGC00091582-03,
NCGC00091582-04,
NCGC00178705-01,
NCGC00178705-02,
NCGC00256998-01,
NCGC00259906-01,
4CN-0945,
AC-20189,
AJ-09777,
BAS 00674110,
CC-24574,
CJ-00484,
NCI60_042121,
SC-46077,
ST057259,
ZB002242,
SBI-0051583.P002,
4-methoxy-7-furo[3,2-g][1]benzopyranone,
AB0019675,
AX8014410,
ST2411501,
TR-017690,
4-Methoxy-7H-furo[3,2-g]benzopyran-7-one,
B2840,
FT-0603416,
N1304,
SW220008-1,
V0122,
4-Methoxy-7H-furo[3,2-g]chromen-7-one #,
C01557,
D07521,
M-9412,
AB00052148_06,
AB00052148_07,
484B208,
A827532,
C-11626,
SR-05000002173-2,
SR-05000002173-3,
SR-05000002173-5,
BRD-K12968785-001-02-6,
BRD-K12968785-001-03-4,
BRD-K12968785-001-06-7,
BRD-K12968785-001-11-7,
I14-13388,
6-Hydroxy-4-methoxy-5-benzofuranacrylic acid, .gamma.-lactone,
InChI=1/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H,
Isopimpinellin,
5 Methoxy Psoralen,
D0QR5G,
C12H8O4,
CID2355,
C12-H8-O4,
NA1759,
UN1759,
5-Methoxypsoralen, 98% - 1G 1g,
ACN-035380,
C022909,
D000078223,
|
| Complexity | 325 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.192g/mol |
| Monoisotopic Mass | 216.042g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302-H315-H319-H335-H350-H360 |
| Packing Group | |
| Precautionary statements | P261-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

